Environment Exposure Ontology
type: Ontology
version IRI: ecto.owl
has ontology root term: http://purl.obolibrary.org/obo/ExO_0000002
description: ECTO describes exposures to experimental treatments of plants and model organisms (e.g. exposures to modification of diet, lighting levels, temperature); exposures of humans or any other organisms to stressors through a variety of routes, for purposes of public health, environmental monitoring etc, stimuli, natural and experimental, any kind of environmental condition or change in condition that can be experienced by an organism or population of organisms on earth. The scope is very general and can include for example plant treatment regimens, as well as human clinical exposures (although these may better be handled by a more specialized ontology).
license: https://creativecommons.org/publicdomain/zero/1.0/
version info: 2023-02-14

definition
type: AnnotationProperty
IAO_0000111: definition
IAO_0000111: textual definition
IAO_0000114: IAO_0000122
definition: A property representing the English language definitions of what NCI means by the concept. They may also include information about the definition's source and attribution in a form that can easily be interpreted by software.
definition: English language definitions of what NCI means by the concept. These are limited to 1024 characters. They may also include information about the definition's source and attribution in a form that can easily be interpreted by software.
definition: The official OBI definition, explaining the meaning of a class or property. Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions.
definition: The official definition, explaining the meaning of a class or property. Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions.
editor note: 2012-04-05: Barry Smith The official OBI definition, explaining the meaning of a class or property: 'Shall be Aristotelian, formalized and normalized. Can be augmented with colloquial definitions' is terrible. Can you fix to something like: A statement of necessary and sufficient conditions explaining the meaning of an expression referring to a class or property. Alan Ruttenberg Your proposed definition is a reasonable candidate, except that it is very common that necessary and sufficient conditions are not given. Mostly they are necessary, occasionally they are necessary and sufficient or just sufficient. Often they use terms that are not themselves defined and so they effectively can't be evaluated by those criteria. On the specifics of the proposed definition: We don't have definitions of 'meaning' or 'expression' or 'property'. For 'reference' in the intended sense I think we use the term 'denotation'. For 'expression', I think we you mean symbol, or identifier. For 'meaning' it differs for class and property. For class we want documentation that let's the intended reader determine whether an entity is instance of the class, or not. For property we want documentation that let's the intended reader determine, given a pair of potential relata, whether the assertion that the relation holds is true. The 'intended reader' part suggests that we also specify who, we expect, would be able to understand the definition, and also generalizes over human and computer reader to include textual and logical definition. Personally, I am more comfortable weakening definition to documentation, with instructions as to what is desirable. We also have the outstanding issue of how to aim different definitions to different audiences. A clinical audience reading chebi wants a different sort of definition documentation/definition from a chemistry trained audience, and similarly there is a need for a definition that is adequate for an ontologist to work with.
IAO_0000117: PERSON:Daniel Schober
IAO_0000119: GROUP:OBI:<http://purl.obolibrary.org/obo/obi>
has exact synonym: DEFINITION
label: textual definition

Axiom
annotated source: definition
annotated property: definition
annotated target: A property representing the English language definitions of what NCI means by the concept. They may also include information about the definition's source and attribution in a form that can easily be interpreted by software.
NCIT P378: NCI

Axiom
annotated source: definition
annotated property: has exact synonym
annotated target: DEFINITION
NCIT P383: PT
NCIT P384: NCI

editor note
type: AnnotationProperty

has ontology root term
type: AnnotationProperty
database_cross_reference: IAO:0000700
has OBO namespace: uberon
id: has_ontology_root_term
is metadata tag: true
shorthand: has_ontology_root_term
label: preferred_root

term replaced by
type: AnnotationProperty
IAO_0000111: term replaced by
IAO_0000114: IAO_0000125
definition: Add as annotation triples in the granting ontology
definition: Use on obsolete terms, relating the term to another term that can be used as a substitute
IAO_0000117: Person:Alan Ruttenberg
IAO_0000119: Person:Alan Ruttenberg

is a defining property chain axiom
type: AnnotationProperty
definition: If R <- P o Q is a defining property chain axiom, then it also holds that R -> P o Q. Note that this cannot be expressed directly in OWL

is a defining property chain axiom where second argument is reflexive
type: AnnotationProperty
definition: If R <- P o Q is a defining property chain axiom, then (1) R -> P o Q holds and (2) Q is either reflexive or locally reflexive. A corollary of this is that P SubPropertyOf R.

mrex
type: AnnotationProperty
comment: medically relevant exposure
sub property of: subset property

description
type: AnnotationProperty
has OBO namespace: uberon
id: dc-description
is metadata tag: true
shorthand: dc-description

title
type: AnnotationProperty
has OBO namespace: uberon
id: dc-title
is metadata tag: true
shorthand: dc-title

license
type: AnnotationProperty
has OBO namespace: uberon
id: dcterms-license
is metadata tag: true
shorthand: dcterms-license

subset property
type: AnnotationProperty
label: subset_property

database_cross_reference
type: AnnotationProperty
definition: A property representing a reference to an identical or very similar object in another database.
NCIT P106: Conceptual Entity
NCIT P108: xRef
label: xRef

Axiom
annotated source: database_cross_reference
annotated property: definition
annotated target: A property representing a reference to an identical or very similar object in another database.
NCIT P378: NCI
NCIT P381: http://www.geneontology.org/page/ontology-structure

has exact synonym
type: AnnotationProperty
definition: A property representing a fully qualified synonym, contains the string, term type, source, and an optional source code if appropriate. Each subfield is deliniated to facilitate interpretation by software.
has exact synonym: FULL_SYN
has exact synonym: Synonym with Source Data
label: has_exact_synonym

Axiom
annotated source: has exact synonym
annotated property: definition
annotated target: A property representing a fully qualified synonym, contains the string, term type, source, and an optional source code if appropriate. Each subfield is deliniated to facilitate interpretation by software.
NCIT P378: NCI

Axiom
annotated source: has exact synonym
annotated property: has exact synonym
annotated target: FULL_SYN
NCIT P383: PT
NCIT P384: NCI

Axiom
annotated source: has exact synonym
annotated property: has exact synonym
annotated target: Synonym with Source Data
NCIT P383: SY
NCIT P384: NCI

label
type: AnnotationProperty
IAO_0000111: label

part of
type: ObjectProperty
sub property of: overlaps
inverse of: has part
type: TransitiveProperty
IAO_0000111: is part of
IAO_0000112: my brain is part of my body (continuant parthood, two material entities)
IAO_0000112: my stomach cavity is part of my stomach (continuant parthood, immaterial entity is part of material entity)
IAO_0000112: this day is part of this year (occurrent parthood)
definition: For continuants: C part_of C' if and only if: given any c that instantiates C at a time t, there is some c' such that c' instantiates C' at time t, and c *part_of* c' at t. For processes: P part_of P' if and only if: given any p that instantiates P at a time t, there is some p' such that p' instantiates P' at time t, and p *part_of* p' at t. (Here *part_of* is the instance-level part-relation.)
definition: a core relation that holds between a part and its whole
editor note: Everything is part of itself. Any part of any part of a thing is itself part of that thing. Two distinct things cannot be part of each other.
editor note: Occurrents are not subject to change and so parthood between occurrents holds for all the times that the part exists. Many continuants are subject to change, so parthood between continuants will only hold at certain times, but this is difficult to specify in OWL. See http://purl.obolibrary.org/obo/ro/docs/temporal-semantics/
editor note: Occurrents are not subject to change and so parthood between occurrents holds for all the times that the part exists. Many continuants are subject to change, so parthood between continuants will only hold at certain times, but this is difficult to specify in OWL. See https://code.google.com/p/obo-relations/wiki/ROAndTime
editor note: Parthood requires the part and the whole to have compatible classes: only an occurrent can be part of an occurrent; only a process can be part of a process; only a continuant can be part of a continuant; only an independent continuant can be part of an independent continuant; only an immaterial entity can be part of an immaterial entity; only a specifically dependent continuant can be part of a specifically dependent continuant; only a generically dependent continuant can be part of a generically dependent continuant. (This list is not exhaustive.) A continuant cannot be part of an occurrent: use 'participates in'. An occurrent cannot be part of a continuant: use 'has participant'. A material entity cannot be part of an immaterial entity: use 'has location'. A specifically dependent continuant cannot be part of an independent continuant: use 'inheres in'. An independent continuant cannot be part of a specifically dependent continuant: use 'bearer of'.
IAO_0000118: part_of
IAO_0000412: ro.owl
RO_0001900: RO_0001901
RO_0040042: continuant
RO_0040042: occurrent
RO_0040042: independent continuant
RO_0040042: realizable entity
RO_0040042: quality
RO_0040042: specifically dependent continuant
RO_0040042: generically dependent continuant
database_cross_reference: BFO:0000050
has OBO namespace: experimental_condition_ontology
has OBO namespace: external
has OBO namespace: quality
has OBO namespace: source
has OBO namespace: spatial
has OBO namespace: uberon
id: part_of
in subset: valid for go annotation extension
in subset: valid for go gp2term
in subset: valid for go ontology
in subset: valid for gocam
shorthand: part_of
label: part_of

Axiom
annotated source: part of
annotated property: definition
annotated target: For continuants: C part_of C' if and only if: given any c that instantiates C at a time t, there is some c' such that c' instantiates C' at time t, and c *part_of* c' at t. For processes: P part_of P' if and only if: given any p that instantiates P at a time t, there is some p' such that p' instantiates P' at time t, and p *part_of* p' at t. (Here *part_of* is the instance-level part-relation.)
database_cross_reference: PMID:15892874

has part
type: ObjectProperty
sub property of: overlaps
type: TransitiveProperty
type: ReflexiveProperty
IAO_0000111: has part
IAO_0000112: my body has part my brain (continuant parthood, two material entities)
IAO_0000112: my stomach has part my stomach cavity (continuant parthood, material entity has part immaterial entity)
IAO_0000112: this year has part this day (occurrent parthood)
definition: Q1 has_part Q2 if and only if: every instance of Q1 is a quality_of an entity that has_quality some Q2.
definition: a core relation that holds between a whole and its part
editor note: Everything has itself as a part. Any part of any part of a thing is itself part of that thing. Two distinct things cannot have each other as a part.
editor note: Occurrents are not subject to change and so parthood between occurrents holds for all the times that the part exists. Many continuants are subject to change, so parthood between continuants will only hold at certain times, but this is difficult to specify in OWL. See http://purl.obolibrary.org/obo/ro/docs/temporal-semantics/
editor note: Occurrents are not subject to change and so parthood between occurrents holds for all the times that the part exists. Many continuants are subject to change, so parthood between continuants will only hold at certain times, but this is difficult to specify in OWL. See https://code.google.com/p/obo-relations/wiki/ROAndTime
editor note: Parthood requires the part and the whole to have compatible classes: only an occurrent have an occurrent as part; only a process can have a process as part; only a continuant can have a continuant as part; only an independent continuant can have an independent continuant as part; only a specifically dependent continuant can have a specifically dependent continuant as part; only a generically dependent continuant can have a generically dependent continuant as part. (This list is not exhaustive.) A continuant cannot have an occurrent as part: use 'participates in'. An occurrent cannot have a continuant as part: use 'has participant'. An immaterial entity cannot have a material entity as part: use 'location of'. An independent continuant cannot have a specifically dependent continuant as part: use 'bearer of'. A specifically dependent continuant cannot have an independent continuant as part: use 'inheres in'.
IAO_0000118: has_part
IAO_0000412: obi.owl
IAO_0000412: ro.owl
RO_0001900: RO_0001901
database_cross_reference: BFO:0000051
has OBO namespace: chebi_ontology
has OBO namespace: external
has OBO namespace: quality
has OBO namespace: source
has OBO namespace: spatial
has OBO namespace: uberon
id: has_part
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
is cyclic: false
shorthand: has_part
comment: We use the has_part relation to relate complex qualities to more primitive ones. A complex quality is a collection of qualities. The complex quality cannot exist without the sub-qualities. For example, the quality 'swollen' necessarily comes with the qualities of 'protruding' and 'increased size'.
label: has_part

Axiom
annotated source: has part
annotated property: definition
annotated target: Q1 has_part Q2 if and only if: every instance of Q1 is a quality_of an entity that has_quality some Q2.
database_cross_reference: PATOC:CJM

realized in
type: ObjectProperty
inverse of: realizes
domain: realizable entity
range: process
IAO_0000111: realized in
IAO_0000112: this disease is realized in this disease course
IAO_0000112: this fragility is realized in this shattering
IAO_0000112: this investigator role is realized in this investigation
IAO_0000118: is realized by
IAO_0000118: realized_in
IAO_0000600: [copied from inverse property 'realizes'] to say that b realizes c at t is to assert that there is some material entity d & b is a process which has participant d at t & c is a disposition or role of which d is bearer_of at t& the type instantiated by b is correlated with the type instantiated by c. (axiom label in BFO2 Reference: [059-003])
comment: Paraphrase of elucidation: a relation between a realizable entity and a process, where there is some material entity that is bearer of the realizable entity and participates in the process, and the realizable entity comes to be realized in the course of the process

realizes
type: ObjectProperty
domain: process
range: realizable entity
IAO_0000111: realizes
IAO_0000112: this disease course realizes this disease
IAO_0000112: this investigation realizes this investigator role
IAO_0000112: this shattering realizes this fragility
IAO_0000600: to say that b realizes c at t is to assert that there is some material entity d & b is a process which has participant d at t & c is a disposition or role of which d is bearer_of at t& the type instantiated by b is correlated with the type instantiated by c. (axiom label in BFO2 Reference: [059-003])
comment: Paraphrase of elucidation: a relation between a process and a realizable entity, where there is some material entity that is bearer of the realizable entity and participates in the process, and the realizable entity comes to be realized in the course of the process

preceded by
type: ObjectProperty
sub property of: ends after
inverse of: precedes
type: TransitiveProperty
domain: occurrent
range: occurrent
property chain axiom: part of
property chain axiom: starts during
IAO_0000111: preceded by
definition: X preceded_by Y iff: end(Y) before_or_simultaneous_with start(X)
definition: x is preceded by y if and only if the time point at which y ends is before or equivalent to the time point at which x starts. Formally: x preceded by y iff ω(y) <= α(x), where α is a function that maps a process to a start point, and ω is a function that maps a process to an end point.
editor note: An example is: translation preceded_by transcription; aging preceded_by development (not however death preceded_by aging). Where derives_from links classes of continuants, preceded_by links classes of processes. Clearly, however, these two relations are not independent of each other. Thus if cells of type C1 derive_from cells of type C, then any cell division involving an instance of C1 in a given lineage is preceded_by cellular processes involving an instance of C. The assertion P preceded_by P1 tells us something about Ps in general: that is, it tells us something about what happened earlier, given what we know about what happened later. Thus it does not provide information pointing in the opposite direction, concerning instances of P1 in general; that is, that each is such as to be succeeded by some instance of P. Note that an assertion to the effect that P preceded_by P1 is rather weak; it tells us little about the relations between the underlying instances in virtue of which the preceded_by relation obtains. Typically we will be interested in stronger relations, for example in the relation immediately_preceded_by, or in relations which combine preceded_by with a condition to the effect that the corresponding instances of P and P1 share participants, or that their participants are connected by relations of derivation, or (as a first step along the road to a treatment of causality) that the one process in some way affects (for example, initiates or regulates) the other.
IAO_0000118: is preceded by
IAO_0000118: preceded_by
source: http://www.obofoundry.org/ro/#OBO_REL:preceded_by
database_cross_reference: BFO:0000062
has exact synonym: is preceded by
has exact synonym: takes place after
has OBO namespace: external
has OBO namespace: uberon
id: preceded_by
in subset: ro-eco
shorthand: preceded_by
label: preceded_by

Axiom
annotated source: preceded by
annotated property: has exact synonym
annotated target: is preceded by
database_cross_reference: SIO:000249

Axiom
annotated source: preceded by
annotated property: has exact synonym
annotated target: takes place after
database_cross_reference: Allen:precedes

precedes
type: ObjectProperty
sub property of: temporally related to
type: TransitiveProperty
domain: occurrent
range: occurrent
property chain axiom: part of
IAO_0000111: precedes
definition: x precedes y if and only if the time point at which x ends is before or equivalent to the time point at which y starts. Formally: x precedes y iff ω(x) <= α(y), where α is a function that maps a process to a start point, and ω is a function that maps a process to an end point.
database_cross_reference: BFO:0000063
has OBO namespace: external
has OBO namespace: uberon
id: precedes
in subset: ro-eco
shorthand: precedes

occurs in
type: ObjectProperty
inverse of: contains process
domain: occurrent
range: independent continuant
property chain axiom: part of
IAO_0000111: occurs in
definition: b occurs_in c =def b is a process and c is a material entity or immaterial entity& there exists a spatiotemporal region r and b occupies_spatiotemporal_region r.& forall(t) if b exists_at t then c exists_at t & there exist spatial regions s and s’ where & b spatially_projects_onto s at t& c is occupies_spatial_region s’ at t& s is a proper_continuant_part_of s’ at t
IAO_0000118: occurs_in
IAO_0000118: unfolds in
IAO_0000118: unfolds_in
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
comment: Paraphrase of definition: a relation between a process and an independent continuant, in which the process takes place entirely within the independent continuant

contains process
type: ObjectProperty
IAO_0000111: site of
definition: [copied from inverse property 'occurs in'] b occurs_in c =def b is a process and c is a material entity or immaterial entity& there exists a spatiotemporal region r and b occupies_spatiotemporal_region r.& forall(t) if b exists_at t then c exists_at t & there exist spatial regions s and s’ where & b spatially_projects_onto s at t& c is occupies_spatial_region s’ at t& s is a proper_continuant_part_of s’ at t
comment: Paraphrase of definition: a relation between an independent continuant and a process, in which the process takes place entirely within the independent continuant

in left side of
type: ObjectProperty
sub property of: in lateral side of
definition: X in left side of Y <=> if Y is subdivided into two left and right portions, X is part of the left portion.
database_cross_reference: BSPO:0000120
has OBO namespace: spatial
has OBO namespace: uberon
id: in_left_side_of
shorthand: in_left_side_of

Axiom
annotated source: in left side of
annotated property: definition
annotated target: X in left side of Y <=> if Y is subdivided into two left and right portions, X is part of the left portion.
database_cross_reference: BSPO:PATO_mtg_2009

in right side of
type: ObjectProperty
sub property of: in lateral side of
definition: X in right side of Y <=> if Y is subdivided into two left and right portions, X is part of the right portion.
database_cross_reference: BSPO:0000121
has OBO namespace: spatial
has OBO namespace: uberon
id: in_right_side_of
shorthand: in_right_side_of

Axiom
annotated source: in right side of
annotated property: definition
annotated target: X in right side of Y <=> if Y is subdivided into two left and right portions, X is part of the right portion.
database_cross_reference: BSPO:PATO_mtg_2009

in lateral side of
type: ObjectProperty
sub property of: part of
definition: X in lateral side of Y <=> if X is in left side of Y or X is in right side of Y. X is often, but not always a paired structure
database_cross_reference: BSPO:0000126
has OBO namespace: spatial
has OBO namespace: uberon
id: in_lateral_side_of
shorthand: in_lateral_side_of

Axiom
annotated source: in lateral side of
annotated property: definition
annotated target: X in lateral side of Y <=> if X is in left side of Y or X is in right side of Y. X is often, but not always a paired structure
database_cross_reference: UBERON:cjm

partially_surrounded_by
type: ObjectProperty
IAO_0000112: A duck swimming in a pond is partially surrounded by air and partially surrounded by water.
definition: x partially_surrounded_by y if and only if (1) x is adjacent to y and for the region r that is adjacent to x, r partially overlaps y (2) the shared boundary between x and y occupies a non-trivial proportion of the outermost boundary of x
comment: Definition modified from 'surrounded by'.

derives from part of
type: ObjectProperty
definition: A relation between two distinct material entities, the new entity and the old entity, in which the new entity begins to exist through the separation or transformation of a part of the old entity, and the new entity inherits a significant portion of the matter belonging to that part of the old entity.

results in proliferation of
type: ObjectProperty
comment: To be ceded to RO

generates
type: ObjectProperty
definition: A relation between a process and a disposition such that the existence of the disposition is caused by the execution of the process.
editor note: Consider ceding to RO
created by: https://orcid.org/0000-0002-6601-2165
creation date: 2018-11-03T20:58:13Z

has food substance analog
type: ObjectProperty
type: SymmetricProperty

has defining ingredient
type: ObjectProperty
sub property of: has ingredient
definition: A defining ingredient defines what a food is principally categorized as, rather than an ingredient listed by percentage of weight or volume. A food may have more than one defining ingredient.
IAO_0000117: Damion Dooley
IAO_0000119: FoodOn
IAO_0000600: For example, 'bean soup' has a defining ingredient of some 'bean (whole)'. Similarly, spicy chicken wings require a defining ingredient of (usually minute) amounts of chilli. A soup may 'has ingredient' some bean, but that doesn't make it a 'bean soup', i.e. there should be no inference to that category. However, some classes may have that simple ingredient "necessary and sufficient" equivalency.

has ingredient
type: ObjectProperty
sub property of: has substance added
domain: FOODON_00002403
range: FOODON_00001002
definition: A relation attaching between a food material and another food material that has been added to it at some point in its history.
IAO_0000117: Damion Dooley
IAO_0000119: FoodOn

hasCountryOfOrigin
type: ObjectProperty
IAO_0000118: has country of origin
IAO_0000412: hancestro.owl

has_specified_input
type: ObjectProperty
sub property of: has participant
IAO_0000111: has_specified_input
IAO_0000114: IAO_0000122
definition: The inverse property of is_specified_input_of
IAO_0000412: obi.owl

has_specified_output
type: ObjectProperty
sub property of: has participant
IAO_0000111: has_specified_output
IAO_0000114: IAO_0000122
definition: The inverse property of is_specified_output_of
IAO_0000412: obi.owl

characteristic of
type: ObjectProperty
sub property of: characteristic of part of
inverse of: bearer of
type: FunctionalProperty
IAO_0000111: inheres in
IAO_0000112: this fragility inheres in this vase
IAO_0000112: this fragility is a characteristic of this vase
IAO_0000112: this red color inheres in this apple
IAO_0000112: this red color is a characteristic of this apple
definition: a relation between a specifically dependent continuant (the characteristic) and any other entity (the bearer), in which the characteristic depends on the bearer for its existence.
definition: a relation between a specifically dependent continuant (the dependent) and an independent continuant (the bearer), in which the dependent specifically depends on the bearer for its existence
editor note: A dependent inheres in its bearer at all times for which the dependent exists.
IAO_0000118: inheres_in
IAO_0000412: ro.owl
RO_0001900: RO_0001901
database_cross_reference: RO:0000052
shorthand: characteristic_of
comment: Note that this relation was previously called "inheres in", but was changed to be called "characteristic of" because BFO2 uses "inheres in" in a more restricted fashion. This relation differs from BFO2:inheres_in in two respects: (1) it does not impose a range constraint, and thus it allows qualities of processes, as well as of information entities, whereas BFO2 restricts inheres_in to only apply to independent continuants (2) it is declared functional, i.e. something can only be a characteristic of one thing.
label: inheres in

bearer of
type: ObjectProperty
type: InverseFunctionalProperty
range: specifically dependent continuant
IAO_0000111: bearer of
IAO_0000112: this apple is bearer of this red color
IAO_0000112: this vase is bearer of this fragility
definition: Inverse of characteristic_of
definition: a relation between an independent continuant (the bearer) and a specifically dependent continuant (the dependent), in which the dependent specifically depends on the bearer for its existence
editor note: A bearer can have many dependents, and its dependents can exist for different periods of time, but none of its dependents can exist when the bearer does not exist.
IAO_0000118: bearer_of
IAO_0000118: is bearer of
RO_0001900: RO_0001901
database_cross_reference: RO:0000053
has OBO namespace: external
has OBO namespace: uberon
id: bearer_of
shorthand: bearer_of
shorthand: has_characteristic
label: has characteristic

participates in
type: ObjectProperty
inverse of: has participant
domain: continuant
range: occurrent
IAO_0000111: participates in
IAO_0000112: this blood clot participates in this blood coagulation
IAO_0000112: this input material (or this output material) participates in this process
IAO_0000112: this investigator participates in this investigation
definition: a relation between a continuant and a process, in which the continuant is somehow involved in the process
IAO_0000118: participates_in
IAO_0000412: obi.owl
IAO_0000412: ro.owl
database_cross_reference: RO:0000056
has OBO namespace: external
has OBO namespace: uberon
id: participates_in
shorthand: participates_in
label: participates_in

has participant
type: ObjectProperty
domain: occurrent
range: continuant
property chain axiom: has part
IAO_0000111: has participant
IAO_0000112: this blood coagulation has participant this blood clot
IAO_0000112: this investigation has participant this investigator
IAO_0000112: this process has participant this input material (or this output material)
definition: a relation between a process and a continuant, in which the continuant is somehow involved in the process
editor note: Has_participant is a primitive instance-level relation between a process, a continuant, and a time at which the continuant participates in some way in the process. The relation obtains, for example, when this particular process of oxygen exchange across this particular alveolar membrane has_participant this particular sample of hemoglobin at this particular time.
IAO_0000118: has_participant
IAO_0000412: obi.owl
source: http://www.obofoundry.org/ro/#OBO_REL:has_participant
database_cross_reference: RO:0000057
has OBO namespace: external
id: has_participant
shorthand: has_participant
label: has_participant

function of
type: ObjectProperty
sub property of: characteristic of
inverse of: has function
domain: function
IAO_0000112: this catalysis function is a function of this enzyme
definition: a relation between a function and an independent continuant (the bearer), in which the function specifically depends on the bearer for its existence
editor note: A function inheres in its bearer at all times for which the function exists, however the function need not be realized at all the times that the function exists.
IAO_0000118: function_of
IAO_0000118: is function of
database_cross_reference: RO:0000079
shorthand: function_of
comment: This relation is modeled after the BFO relation of the same name which was in BFO2, but is used in a more restricted sense - specifically, we model this relation as functional (inherited from characteristic-of). Note that this relation is now removed from BFO2020.

quality of
type: ObjectProperty
sub property of: characteristic of
inverse of: has quality
IAO_0000112: this red color is a quality of this apple
definition: a relation between a quality and an independent continuant (the bearer), in which the quality specifically depends on the bearer for its existence
editor note: A quality inheres in its bearer at all times for which the quality exists.
IAO_0000118: is quality of
IAO_0000118: quality_of
database_cross_reference: RO:0000080
shorthand: quality_of
comment: This relation is modeled after the BFO relation of the same name which was in BFO2, but is used in a more restricted sense - specifically, we model this relation as functional (inherited from characteristic-of). Note that this relation is now removed from BFO2020.

role of
type: ObjectProperty
sub property of: characteristic of
inverse of: has role
IAO_0000112: this investigator role is a role of this person
definition: a relation between a role and an independent continuant (the bearer), in which the role specifically depends on the bearer for its existence
editor note: A role inheres in its bearer at all times for which the role exists, however the role need not be realized at all the times that the role exists.
IAO_0000118: is role of
IAO_0000118: role_of
database_cross_reference: RO:0000081
shorthand: role_of
comment: This relation is modeled after the BFO relation of the same name which was in BFO2, but is used in a more restricted sense - specifically, we model this relation as functional (inherited from characteristic-of). Note that this relation is now removed from BFO2020.

has function
type: ObjectProperty
sub property of: bearer of
domain: independent continuant
range: function
IAO_0000112: this enzyme has function this catalysis function (more colloquially: this enzyme has this catalysis function)
definition: a relation between an independent continuant (the bearer) and a function, in which the function specifically depends on the bearer for its existence
editor note: A bearer can have many functions, and its functions can exist for different periods of time, but none of its functions can exist when the bearer does not exist. A function need not be realized at all the times that the function exists.
IAO_0000118: has_function
database_cross_reference: RO:0000085
shorthand: has_function

has quality
type: ObjectProperty
sub property of: bearer of
range: quality
IAO_0000112: this apple has quality this red color
definition: a relation between an independent continuant (the bearer) and a quality, in which the quality specifically depends on the bearer for its existence
editor note: A bearer can have many qualities, and its qualities can exist for different periods of time, but none of its qualities can exist when the bearer does not exist.
IAO_0000118: has_quality
IAO_0000412: ro.owl
database_cross_reference: RO:0000086
has OBO namespace: uberon
id: has_quality
shorthand: has_quality

has role
type: ObjectProperty
sub property of: bearer of
domain: independent continuant
range: role
IAO_0000112: this person has role this investigator role (more colloquially: this person has this role of investigator)
definition: a relation between an independent continuant (the bearer) and a role, in which the role specifically depends on the bearer for its existence
editor note: A bearer can have many roles, and its roles can exist for different periods of time, but none of its roles can exist when the bearer does not exist. A role need not be realized at all the times that the role exists.
IAO_0000118: has_role
IAO_0000412: ro.owl
database_cross_reference: RO:0000087
has OBO namespace: chebi_ontology
id: has_role
is cyclic: false
is transitive: false
shorthand: has_role

has disposition
type: ObjectProperty
sub property of: bearer of
inverse of: disposition of
domain: independent continuant
range: disposition
definition: a relation between an independent continuant (the bearer) and a disposition, in which the disposition specifically depends on the bearer for its existence
database_cross_reference: RO:0000091
shorthand: has_disposition

disposition of
type: ObjectProperty
sub property of: characteristic of
definition: inverse of has disposition
database_cross_reference: RO:0000092
in subset: RO_0002259
shorthand: disposition_of
comment: This relation is modeled after the BFO relation of the same name which was in BFO2, but is used in a more restricted sense - specifically, we model this relation as functional (inherited from characteristic-of). Note that this relation is now removed from BFO2020.

derives from
type: ObjectProperty
sub property of: derives from part of
inverse of: derives into
IAO_0000112: this cell derives from this parent cell (cell division)
IAO_0000112: this nucleus derives from this parent nucleus (nuclear division)
IAO_0000114: IAO_0000125
definition: a relation between two distinct material entities, the new entity and the old entity, in which the new entity begins to exist when the old entity ceases to exist, and the new entity inherits the significant portion of the matter of the old entity
editor note: This is a very general relation. More specific relations are preferred when applicable, such as 'directly develops from'.
IAO_0000118: derives_from
IAO_0000232: This relation is taken from the RO2005 version of RO. It may be obsoleted and replaced by relations with different definitions. See also the 'develops from' family of relations.
IAO_0000412: ro.owl
in subset: ro-eco

derives into
type: ObjectProperty
IAO_0000112: this parent cell derives into this cell (cell division)
IAO_0000112: this parent nucleus derives into this nucleus (nuclear division)
IAO_0000114: IAO_0000125
definition: a relation between two distinct material entities, the old entity and the new entity, in which the new entity begins to exist when the old entity ceases to exist, and the new entity inherits the significant portion of the matter of the old entity
editor note: This is a very general relation. More specific relations are preferred when applicable, such as 'directly develops into'. To avoid making statements about a future that may not come to pass, it is often better to use the backward-looking 'derives from' rather than the forward-looking 'derives into'.
IAO_0000118: derives_into
in subset: ro-eco

contained in
type: ObjectProperty
inverse of: contains
domain: material entity
range: independent continuant
property chain axiom: located_in
property chain axiom: part of
IAO_0000111: contained in
editor note: Containment is location not involving parthood, and arises only where some immaterial continuant is involved.
editor note: Containment obtains in each case between material and immaterial continuants, for instance: lung contained_in thoracic cavity; bladder contained_in pelvic cavity. Hence containment is not a transitive relation. If c part_of c1 at t then we have also, by our definition and by the axioms of mereology applied to spatial regions, c located_in c1 at t. Thus, many examples of instance-level location relations for continuants are in fact cases of instance-level parthood. For material continuants location and parthood coincide. Containment is location not involving parthood, and arises only where some immaterial continuant is involved. To understand this relation, we first define overlap for continuants as follows: c1 overlap c2 at t =def for some c, c part_of c1 at t and c part_of c2 at t. The containment relation on the instance level can then be defined (see definition):
editor note: Intended meaning: domain: material entity range: spatial region or site (immaterial continuant)
IAO_0000118: contained_in
RO_0001900: RO_0001901
in subset: ro-eco

contains
type: ObjectProperty
IAO_0000111: contains
RO_0001900: RO_0001901
in subset: ro-eco

located_in
type: ObjectProperty
type: TransitiveProperty
domain: independent continuant
domain: Class
  intersection of: independent continuant
  intersection of: Class
    complement of: spatial region
range: independent continuant
range: Class
  intersection of: independent continuant
  intersection of: Class
    complement of: spatial region
property chain axiom: part of
IAO_0000111: located in
IAO_0000112: my brain is located in my head
IAO_0000112: this rat is located in this cage
definition: a relation between two independent continuants, the target and the location, in which the target is entirely within the location
editor note: Location as a relation between instances: The primitive instance-level relation c located_in r at t reflects the fact that each continuant is at any given time associated with exactly one spatial region, namely its exact location. Following we can use this relation to define a further instance-level location relation - not between a continuant and the region which it exactly occupies, but rather between one continuant and another. c is located in c1, in this sense, whenever the spatial region occupied by c is part_of the spatial region occupied by c1. Note that this relation comprehends both the relation of exact location between one continuant and another which obtains when r and r1 are identical (for example, when a portion of fluid exactly fills a cavity), as well as those sorts of inexact location relations which obtain, for example, between brain and head or between ovum and uterus
editor note: Most location relations will only hold at certain times, but this is difficult to specify in OWL. See http://purl.obolibrary.org/obo/ro/docs/temporal-semantics/
IAO_0000118: located_in
IAO_0000412: ro.owl
RO_0001900: RO_0001901
source: http://www.obofoundry.org/ro/#OBO_REL:located_in
in subset: valid for go gp2term
label: located in

Axiom
annotated source: located_in
annotated property: domain
annotated target: independent continuant
editor note: This is redundant with the more specific 'independent and not spatial region' constraint. We leave in the redundant axiom for use with reasoners that do not use negation.

Axiom
annotated source: located_in
annotated property: range
annotated target: independent continuant
editor note: This is redundant with the more specific 'independent and not spatial region' constraint. We leave in the redundant axiom for use with reasoners that do not use negation.

bounding layer of
type: ObjectProperty
sub property of: part of
domain: Class
  intersection of: material entity
  intersection of: Restriction
    on property: bearer of
    some values from: PATO_0002124
range: material entity
definition: X outer_layer_of Y iff: . X :continuant that bearer_of some PATO:laminar . X part_of Y . exists Z :surface . X has_boundary Z . Z boundary_of Y has_boundary: http://purl.obolibrary.org/obo/RO_0002002 boundary_of: http://purl.obolibrary.org/obo/RO_0002000
IAO_0000117: David Osumi-Sutherland
in subset: ro-eco
comment: A relationship that applies between a continuant and its outer, bounding layer. Examples include the relationship between a multicellular organism and its integument, between an animal cell and its plasma membrane, and between a membrane bound organelle and its outer/bounding membrane.

has regulatory component activity
type: ObjectProperty
sub property of: has component activity
sub property of: regulated by
definition: A 'has regulatory component activity' B if A and B are GO molecular functions (GO_0003674), A has_component B and A is regulated by B.
created by: dos
creation date: 2017-05-24T09:30:46Z
database_cross_reference: RO:0002013
has OBO namespace: external
id: has_regulatory_component_activity
shorthand: has_regulatory_component_activity

has negative regulatory component activity
type: ObjectProperty
sub property of: has regulatory component activity
sub property of: negatively regulated by
definition: A relationship that holds between a GO molecular function and a component of that molecular function that negatively regulates the activity of the whole. More formally, A 'has regulatory component activity' B iff :A and B are GO molecular functions (GO_0003674), A has_component B and A is negatively regulated by B.
created by: dos
creation date: 2017-05-24T09:31:01Z
database_cross_reference: RO:0002014
has OBO namespace: external
id: has_negative_regulatory_component_activity
shorthand: has_negative_regulatory_component_activity
comment: By convention GO molecular functions are classified by their effector function. Internal regulatory functions are treated as components. For example, NMDA glutmate receptor activity is a cation channel activity with positive regulatory component 'glutamate binding' and negative regulatory components including 'zinc binding' and 'magnesium binding'.

has positive regulatory component activity
type: ObjectProperty
sub property of: has regulatory component activity
sub property of: positively regulated by
definition: A relationship that holds between a GO molecular function and a component of that molecular function that positively regulates the activity of the whole. More formally, A 'has regulatory component activity' B iff :A and B are GO molecular functions (GO_0003674), A has_component B and A is positively regulated by B.
created by: dos
creation date: 2017-05-24T09:31:17Z
database_cross_reference: RO:0002015
shorthand: has_positive_regulatory_component_activity
comment: By convention GO molecular functions are classified by their effector function and internal regulatory functions are treated as components. So, for example calmodulin has a protein binding activity that has positive regulatory component activity calcium binding activity. Receptor tyrosine kinase activity is a tyrosine kinase activity that has positive regulatory component 'ligand binding'.

has component activity
type: ObjectProperty
sub property of: has component process
created by: dos
creation date: 2017-05-24T09:44:33Z
database_cross_reference: RO:0002017
shorthand: has_component_activity
comment: A 'has component activity' B if A is A and B are molecular functions (GO_0003674) and A has_component B.

has component process
type: ObjectProperty
sub property of: has component
domain: process
range: process
definition: w 'has process component' p if p and w are processes, w 'has part' p and w is such that it can be directly disassembled into into n parts p, p2, p3, ..., pn, where these parts are of similar type.
created by: dos
creation date: 2017-05-24T09:49:21Z
database_cross_reference: RO:0002018
shorthand: has_component_process

directly regulated by
type: ObjectProperty
sub property of: regulated by
inverse of: directly regulates
created by: dos
creation date: 2017-09-17T13:52:24Z
database_cross_reference: RO:0002022
shorthand: directly_regulated_by
comment: Process(P2) is directly regulated by process(P1) iff: P1 regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding regulates the kinase activity (P2) of protein B then P1 directly regulates P2.

Axiom
annotated source: directly regulated by
annotated property: comment
annotated target: Process(P2) is directly regulated by process(P1) iff: P1 regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding regulates the kinase activity (P2) of protein B then P1 directly regulates P2.
database_cross_reference: GOC:dos

directly negatively regulated by
type: ObjectProperty
sub property of: directly regulated by
inverse of: directly negatively regulates
definition: Process(P2) is directly negatively regulated by process(P1) iff: P1 negatively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding negatively regulates the kinase activity (P2) of protein B then P2 directly negatively regulated by P1.
created by: dos
creation date: 2017-09-17T13:52:38Z
database_cross_reference: RO:0002023
shorthand: directly_negatively_regulated_by

Axiom
annotated source: directly negatively regulated by
annotated property: definition
annotated target: Process(P2) is directly negatively regulated by process(P1) iff: P1 negatively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding negatively regulates the kinase activity (P2) of protein B then P2 directly negatively regulated by P1.
database_cross_reference: GOC:dos

directly positively regulated by
type: ObjectProperty
sub property of: directly regulated by
inverse of: directly positively regulates
definition: Process(P2) is directly postively regulated by process(P1) iff: P1 positively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding positively regulates the kinase activity (P2) of protein B then P2 is directly postively regulated by P1.
created by: dos
creation date: 2017-09-17T13:52:47Z
database_cross_reference: RO:0002024
shorthand: directly_positively_regulated_by

Axiom
annotated source: directly positively regulated by
annotated property: definition
annotated target: Process(P2) is directly postively regulated by process(P1) iff: P1 positively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding positively regulates the kinase activity (P2) of protein B then P2 is directly postively regulated by P1.
database_cross_reference: GOC:dos

has effector activity
type: ObjectProperty
sub property of: has component activity
sub property of: regulates
type: FunctionalProperty
definition: A 'has effector activity' B if A and B are GO molecular functions (GO_0003674), A 'has component activity' B and B is the effector (output function) of B. Each compound function has only one effector activity.
created by: dos
creation date: 2017-09-22T14:14:36Z
database_cross_reference: RO:0002025
shorthand: has_effector_activity
comment: This relation is designed for constructing compound molecular functions, typically in combination with one or more regulatory component activity relations.

Axiom
annotated source: has effector activity
annotated property: definition
annotated target: A 'has effector activity' B if A and B are GO molecular functions (GO_0003674), A 'has component activity' B and B is the effector (output function) of B. Each compound function has only one effector activity.
database_cross_reference: GOC:dos

during which ends
type: ObjectProperty
sub property of: temporally related to
inverse of: ends during
IAO_0000117: David Osumi-Sutherland
in subset: ro-eco
comment: Previously had ID http://purl.obolibrary.org/obo/RO_0002122 in test files in sandpit - but this seems to have been dropped from ro-edit.owl at some point. No re-use under this ID AFAIK, but leaving note here in case we run in to clashes down the line. Official ID now chosen from DOS ID range.

ends after
type: ObjectProperty
sub property of: temporally related to
type: TransitiveProperty
property chain axiom: ends during
property chain axiom: preceded by
IAO_0000117: David Osumi-Sutherland
database_cross_reference: RO:0002086
in subset: ro-eco
shorthand: ends_after
comment: X ends_after Y iff: end(Y) before_or_simultaneous_with end(X)

immediately preceded by
type: ObjectProperty
sub property of: preceded by
inverse of: immediately precedes
property chain axiom: starts with
property chain axiom: ends with
definition: X immediately_preceded_by Y iff: end(X) simultaneous_with start(Y)
IAO_0000117: David Osumi-Sutherland
IAO_0000118: starts_at_end_of
UBPROP_0000001: A non-transitive temporal relation in which one process immediately precedes another process, such that there is no interval of time between the two processes[SIO:000251].
database_cross_reference: RO:0002087
has exact synonym: directly preceded by
has exact synonym: is directly preceded by
has exact synonym: is immediately preceded by
has exact synonym: starts_at_end_of
has OBO namespace: external
has OBO namespace: uberon
id: immediately_preceded_by
shorthand: immediately_preceded_by
comment: X immediately_preceded_by Y iff: end(X) simultaneous_with start(Y)
label: immediately_preceded_by

Axiom
annotated source: immediately preceded by
annotated property: UBPROP_0000001
annotated target: A non-transitive temporal relation in which one process immediately precedes another process, such that there is no interval of time between the two processes[SIO:000251].
source: SIO:000251

Axiom
annotated source: immediately preceded by
annotated property: has exact synonym
annotated target: is immediately preceded by
database_cross_reference: SIO:000251

during which starts
type: ObjectProperty
sub property of: temporally related to
inverse of: starts during
IAO_0000117: David Osumi-Sutherland
in subset: ro-eco
comment: Previously had ID http://purl.obolibrary.org/obo/RO_0002123 in test files in sandpit - but this seems to have been dropped from ro-edit.owl at some point. No re-use under this ID AFAIK, but leaving note here in case we run in to clashes down the line. Official ID now chosen from DOS ID range.

immediately precedes
type: ObjectProperty
sub property of: precedes
property chain axiom: ends with
property chain axiom: starts with
IAO_0000117: David Osumi-Sutherland
IAO_0000118: ends_at_start_of
IAO_0000118: meets
RO_0002575: precedes
database_cross_reference: RO:0002090
has OBO namespace: external
id: immediately_precedes
in subset: ro-eco
shorthand: immediately_precedes
comment: X immediately_precedes_Y iff: end(X) simultaneous_with start(Y)

starts during
type: ObjectProperty
sub property of: temporally related to
domain: occurrent
range: occurrent
IAO_0000117: David Osumi-Sutherland
IAO_0000118: io
in subset: ro-eco
comment: X starts_during Y iff: (start(Y) before_or_simultaneous_with start(X)) AND (start(X) before_or_simultaneous_with end(Y))

ends during
type: ObjectProperty
sub property of: temporally related to
IAO_0000117: David Osumi-Sutherland
IAO_0000118: o
IAO_0000118: overlaps
in subset: ro-eco
comment: X ends_during Y iff: ((start(Y) before_or_simultaneous_with end(X)) AND end(X) before_or_simultaneous_with end(Y).

overlaps
type: ObjectProperty
sub property of: mereotopologically related to
type: SymmetricProperty
property chain axiom: part of
property chain axiom: has part
IAO_0000114: IAO_0000125
definition: x overlaps y if and only if there exists some z such that x has part z and z part of y
definition: x overlaps y iff they have some part in common.
IAO_0000424: http://purl.obolibrary.org/obo/BFO_0000051 some (http://purl.obolibrary.org/obo/BFO_0000050 some ?Y)
RO_0001900: RO_0001901
database_cross_reference: RO:0002131
has OBO namespace: external
has OBO namespace: spatial
has OBO namespace: uberon
id: overlaps
in subset: valid for go annotation extension
in subset: valid for gocam
in subset: ro-eco
shorthand: overlaps
comment: "(forall (x y) (iff (overlaps x y) (exists (z) (and (part of z x) (part of z y)))))" CLIF []

Axiom
annotated source: overlaps
annotated property: propertyChainAxiom
annotated target: has part
annotated target: part of
RO_0002582: true

Axiom
annotated source: overlaps
annotated property: definition
annotated target: x overlaps y iff they have some part in common.
database_cross_reference: BSPO:cjm

continuous with
type: ObjectProperty
sub property of: mereotopologically related to
type: SymmetricProperty
domain: independent continuant
range: independent continuant
IAO_0000114: IAO_0000125
definition: X continuous_with Y if and only if X and Y share a fiat boundary.
IAO_0000117: David Osumi-Sutherland
IAO_0000118: connected to
IAO_0000232: The label for this relation was previously connected to. I relabeled this to "continuous with". The standard notion of connectedness does not imply shared boundaries - e.g. Glasgow connected_to Edinburgh via M8; my patella connected_to my femur (via patellar-femoral joint)
RO_0001900: RO_0001901

only in taxon
type: ObjectProperty
sub property of: in taxon
IAO_0000112: lactation SubClassOf 'only in taxon' some 'Mammalia'
IAO_0000114: IAO_0000125
definition: x only in taxon y if and only if x is in taxon y, and there is no other organism z such that y!=z a and x is in taxon z.
editor note: The original intent was to treat this as a macro that expands to 'in taxon' only ?Y - however, this is not necessary if we instead have supplemental axioms that state that each pair of sibling tax have a disjointness axiom using the 'in taxon' property - e.g. 'in taxon' some Eukaryota DisjointWith 'in taxon' some Eubacteria
IAO_0000117: Chris Mungall
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/17921072
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/20973947
database_cross_reference: RO:0002160
has OBO namespace: uberon
id: only_in_taxon
shorthand: only_in_taxon

in taxon
type: ObjectProperty
sub property of: evolutionarily related to
range: organism or virus or viroid
property chain axiom: part of
property chain axiom: has part
property chain axiom: overlaps
property chain axiom: capable of
property chain axiom: results in developmental progression of
IAO_0000114: IAO_0000125
definition: x is in taxon y if an only if y is an organism, and the relationship between x and y is one of: part of (reflexive), developmentally preceded by, derives from, secreted by, expressed.
IAO_0000117: Chris Mungall
IAO_0000117: Jennifer Deegan
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/17921072
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/20973947
IAO_0000412: ro.owl
database_cross_reference: RO:0002162
has OBO namespace: uberon
id: in_taxon
in subset: ro-eco
shorthand: in_taxon
comment: Connects a biological entity to its taxon of origin.

spatially disjoint from
type: ObjectProperty
sub property of: mereotopologically related to
IAO_0000114: IAO_0000125
definition: A is spatially_disjoint_from B if and only if they have no parts in common
editor note: There are two ways to encode this as a shortcut relation. The other possibility to use an annotation assertion between two classes, and expand this to a disjointness axiom.
IAO_0000117: Chris Mungall
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/22293552
IAO_0000232: Note that it would be possible to use the relation to label the relationship between a near infinite number of structures - between the rings of saturn and my left earlobe. The intent is that this is used for parsiomoniously for disambiguation purposes - for example, between siblings in a jointly exhaustive pairwise disjointness hierarchy
IAO_0000424: BFO_0000051 exactly 0 (BFO_0000050 some ?Y)
RO_0001900: RO_0001901
in subset: ro-eco

connected to
type: ObjectProperty
sub property of: mereotopologically related to
domain: Restriction
  on property: part of
  some values from: RO_0002577
range: Restriction
  on property: part of
  some values from: RO_0002577
property chain axiom:
  inverse of: connects
property chain axiom: connects
IAO_0000112: a 'toe distal phalanx bone' that is connected to a 'toe medial phalanx bone' (an interphalangeal joint *connects* these two bones).
definition: a is connected to b if and only if a and b are discrete structure, and there exists some connecting structure c, such that c connects a and b
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/22293552

connects
type: ObjectProperty
sub property of: mereotopologically related to
domain: independent continuant
range: Restriction
  on property: part of
  some values from: RO_0002577
IAO_0000112: The M8 connects Glasgow and Edinburgh
IAO_0000112: a 'toe distal phalanx bone' that is connected to a 'toe medial phalanx bone' (an interphalangeal joint *connects* these two bones).
definition: c connects a if and only if there exist some b such that a and b are similar parts of the same system, and c connects b, specifically, c connects a with b. When one structure connects two others it unites some aspect of the function or role they play within the system.
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/22293552

has component
type: ObjectProperty
sub property of: has part
IAO_0000114: IAO_0000125
definition: w 'has component' p if w 'has part' p and w is such that it can be directly disassembled into into n parts p, p2, p3, ..., pn, where these parts are of similar type.
editor note: The definition of 'has component' is still under discussion. The challenge is in providing a definition that does not imply transitivity.
IAO_0000232: For use in recording has_part with a cardinality constraint, because OWL does not permit cardinality constraints to be used in combination with transitive object properties. In situations where you would want to say something like 'has part exactly 5 digit, you would instead use has_component exactly 5 digit.
RO_0001900: RO_0001901
database_cross_reference: RO:0002180
has OBO namespace: external
has OBO namespace: uberon
id: has_component
in subset: ro-eco
shorthand: has_component

develops from
type: ObjectProperty
sub property of: developmentally preceded by
inverse of: develops into
type: TransitiveProperty
domain: independent continuant
range: independent continuant
IAO_0000114: IAO_0000125
definition: x develops from y if and only if either (a) x directly develops from y or (b) there exists some z such that x directly develops from z and z develops from y
IAO_0000117: Chris Mungall
IAO_0000117: David Osumi-Sutherland
IAO_0000117: Melissa Haendel
IAO_0000117: Terry Meehan
comment: This is the transitive form of the develops from relation
label: develops_from

develops into
type: ObjectProperty
sub property of: developmentally succeeded by
sub property of: has potential to develop into
sub property of: has potential to directly develop into
type: TransitiveProperty
IAO_0000114: IAO_0000125
definition: inverse of develops from
IAO_0000117: Chris Mungall
IAO_0000117: David Osumi-Sutherland
IAO_0000117: Terry Meehan
in subset: RO_0002259

directly develops from
type: ObjectProperty
sub property of: develops from
inverse of: directly develops into
domain: Class
  union of: CARO_0010000
  union of: CL_0000000
range: Class
  union of: CARO_0010000
  union of: CL_0000000
IAO_0000114: IAO_0000125
definition: Candidate definition: x directly_develops from y if and only if there exists some developmental process (GO:0032502) p such that x and y both participate in p, and x is the output of p and y is the input of p, and a substantial portion of the matter of x comes from y, and the start of x is coincident with or after the end of y.
IAO_0000117: Chris Mungall
IAO_0000117: David Osumi-Sutherland
IAO_0000117: has developmental precursor
IAO_0000119: FBbt
RO_0002575: develops from
comment: TODO - add child relations from DOS

directly develops into
type: ObjectProperty
sub property of: develops into
IAO_0000114: IAO_0000125
definition: inverse of directly develops from
IAO_0000118: developmental precursor of
in subset: RO_0002259

regulates
type: ObjectProperty
sub property of: causally upstream of
inverse of: regulated by
type: TransitiveProperty
domain: process
range: process
property chain axiom: has effector activity
property chain axiom: ends with
property chain axiom: directly regulates
IAO_0000114: IAO_0000125
definition: p regulates q iff p is causally upstream of q, the execution of p is not constant and varies according to specific conditions, and p influences the rate or magnitude of execution of q due to an effect either on some enabler of q or some enabler of a part of q.
definition: process(P1) regulates process(P2) iff: P1 results in the initiation or termination of P2 OR affects the frequency of its initiation or termination OR affects the magnitude or rate of output of P2.
editor note: We use 'regulates' here to specifically imply control. However, many colloquial usages of the term correctly correspond to the weaker relation of 'causally upstream of or within' (aka influences). Consider relabeling to make things more explicit
IAO_0000117: Chris Mungall
IAO_0000117: David Hill
IAO_0000117: Tanya Berardini
IAO_0000119: causal-relations
IAO_0000119: GO
IAO_0000232: Regulation precludes parthood; the regulatory process may not be within the regulated process.
IAO_0000589: regulates (processual)
IAO_0000600: false
database_cross_reference: RO:0002211
has OBO namespace: external
id: regulates
in subset: valid for go annotation extension
in subset: valid for go gp2term
in subset: valid for go ontology
in subset: valid for gocam
shorthand: regulates
label: regulates (processual)

negatively regulates
type: ObjectProperty
sub property of: regulates
sub property of: causally upstream of, negative effect
inverse of: negatively regulated by
property chain axiom: ends with
definition: Process(P1) negatively regulates process(P2) iff: P1 terminates P2, or P1 descreases the the frequency of initiation of P2 or the magnitude or rate of output of P2.
definition: p negatively regulates q iff p regulates q, and p decreases the rate or magnitude of execution of q.
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000589: negatively regulates (process to process)
RO_0004050: regulates
database_cross_reference: RO:0002212
has OBO namespace: external
id: negatively_regulates
in subset: valid for go annotation extension
in subset: valid for go gp2term
in subset: valid for go ontology
in subset: valid for gocam
shorthand: negatively_regulates

positively regulates
type: ObjectProperty
sub property of: regulates
sub property of: causally upstream of, positive effect
inverse of: positively regulated by
type: TransitiveProperty
property chain axiom: negatively regulates
property chain axiom: ends with
definition: Process(P1) postively regulates process(P2) iff: P1 initiates P2, or P1 increases the the frequency of initiation of P2 or the magnitude or rate of output of P2.
definition: p positively regulates q iff p regulates q, and p increases the rate or magnitude of execution of q.
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000589: positively regulates (process to process)
RO_0004049: regulates
database_cross_reference: RO:0002213
has OBO namespace: external
id: positively_regulates
in subset: valid for go annotation extension
in subset: valid for go gp2term
in subset: valid for go ontology
in subset: valid for gocam
shorthand: positively_regulates

capable of
type: ObjectProperty
sub property of: capable of part of
sub property of: functionally related to
domain: independent continuant
range: process
IAO_0000112: mechanosensory neuron capable of detection of mechanical stimulus involved in sensory perception (GO:0050974)
IAO_0000112: osteoclast SubClassOf 'capable of' some 'bone resorption'
definition: A relation between a material entity (such as a cell) and a process, in which the material entity has the ability to carry out the process.
IAO_0000117: Chris Mungall
IAO_0000118: has function realized in
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/20123131
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/21208450
IAO_0000232: For compatibility with BFO, this relation has a shortcut definition in which the expression "capable of some P" expands to "bearer_of (some realized_by only P)".
IAO_0000424: RO_0000053 some (RO_0000054 only ?Y)
database_cross_reference: RO:0002215
has OBO namespace: external
has OBO namespace: uberon
id: capable_of
in subset: ro-eco
shorthand: capable_of

capable of part of
type: ObjectProperty
sub property of: functionally related to
sub property of: causal agent in process
property chain axiom: capable of
property chain axiom: part of
definition: c stands in this relationship to p if and only if there exists some p' such that c is capable_of p', and p' is part_of p.
IAO_0000117: Chris Mungall
IAO_0000118: has function in
IAO_0000424: RO_0000053 some (RO_0000054 only (BFO_0000050 some ?Y))
database_cross_reference: RO:0002216
has OBO namespace: external
has OBO namespace: uberon
id: capable_of_part_of
shorthand: capable_of_part_of

Axiom
annotated source: capable of part of
annotated property: propertyChainAxiom
annotated target: capable of
annotated target: part of
RO_0002582: true

surrounded by
type: ObjectProperty
sub property of: adjacent to
inverse of: surrounds
IAO_0000114: IAO_0000125
definition: x surrounded_by y if and only if (1) x is adjacent to y and for every region r that is adjacent to x, r overlaps y (2) the shared boundary between x and y occupies the majority of the outermost boundary of x
IAO_0000117: Chris Mungall
RO_0001900: RO_0001901

adjacent to
type: ObjectProperty
sub property of: spatially disjoint from
domain: independent continuant
range: independent continuant
IAO_0000112: A caterpillar walking on the surface of a leaf is adjacent_to the leaf, if one of the caterpillar appendages is touching the leaf. In contrast, a butterfly flying close to a flower is not considered adjacent, unless there are any touching parts.
IAO_0000112: The epidermis layer of a vertebrate is adjacent to the dermis.
IAO_0000112: The plasma membrane of a cell is adjacent to the cytoplasm, and also to the cell lumen which the cytoplasm occupies.
IAO_0000112: The skin of the forelimb is adjacent to the skin of the torso if these are considered anatomical subdivisions with a defined border. Otherwise a relation such as continuous_with would be used.
IAO_0000114: IAO_0000125
definition: x adjacent to y if and only if x and y share a boundary.
editor note: This relation acts as a join point with BSPO
IAO_0000117: Chris Mungall
RO_0001900: RO_0001901
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam

Axiom
annotated source: adjacent to
annotated property: IAO_0000112
annotated target: A caterpillar walking on the surface of a leaf is adjacent_to the leaf, if one of the caterpillar appendages is touching the leaf. In contrast, a butterfly flying close to a flower is not considered adjacent, unless there are any touching parts.

surrounds
type: ObjectProperty
sub property of: adjacent to
IAO_0000114: IAO_0000125
definition: inverse of surrounded by
IAO_0000117: Chris Mungall
RO_0001900: RO_0001901
in subset: RO_0002259

temporally related to
type: ObjectProperty
domain: occurrent
range: occurrent
IAO_0000114: IAO_0000125
IAO_0000117: Chris Mungall
IAO_0000119: Allen's interval algebra
IAO_0000232: Do not use this relation directly. It is ended as a grouping for relations between occurrents involving the relative timing of their starts and ends.
source: https://docs.google.com/document/d/1kBv1ep_9g3sTR-SD3jqzFqhuwo9TPNF-l-9fUDbO6rM/edit
database_cross_reference: RO:0002222
in subset: ro-eco
shorthand: temporally_related_to
comment: A relation that holds between two occurrents. This is a grouping relation that collects together all the Allen relations.

starts
type: ObjectProperty
sub property of: part of
sub property of: temporally related to
inverse of: starts with
IAO_0000114: IAO_0000125
definition: inverse of starts with
IAO_0000117: Chris Mungall
IAO_0000119: Allen
database_cross_reference: RO:0002223
has OBO namespace: uberon
id: starts
in subset: ro-eco
shorthand: starts

starts with
type: ObjectProperty
sub property of: has part
sub property of: temporally related to
type: TransitiveProperty
IAO_0000112: Every insulin receptor signaling pathway starts with the binding of a ligand to the insulin receptor
IAO_0000114: IAO_0000125
definition: x starts with y if and only if x has part y and the time point at which x starts is equivalent to the time point at which y starts. Formally: α(y) = α(x) ∧ ω(y) < ω(x), where α is a function that maps a process to a start point, and ω is a function that maps a process to an end point.
IAO_0000117: Chris Mungall
IAO_0000118: started by
database_cross_reference: RO:0002224
has OBO namespace: external
has OBO namespace: uberon
id: starts_with
in subset: ro-eco
shorthand: starts_with

develops from part of
type: ObjectProperty
sub property of: develops from
property chain axiom: directly develops from
property chain axiom: part of
IAO_0000114: IAO_0000125
definition: x develops from part of y if and only if there exists some z such that x develops from z and z is part of y
IAO_0000117: Chris Mungall

develops in
type: ObjectProperty
sub property of: developmentally preceded by
domain: anatomical entity
property chain axiom: directly develops from
property chain axiom: located_in
IAO_0000114: IAO_0000125
definition: x develops_in y if x is located in y whilst x is developing
IAO_0000117: Chris Mungall
IAO_0000119: EHDAA2
IAO_0000119: Jonathan Bard, EHDAA2

ends
type: ObjectProperty
sub property of: part of
sub property of: temporally related to
inverse of: ends with
IAO_0000114: IAO_0000125
definition: inverse of ends with
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002229
has OBO namespace: uberon
id: ends
in subset: ro-eco
shorthand: ends

ends with
type: ObjectProperty
sub property of: has part
sub property of: temporally related to
type: TransitiveProperty
IAO_0000114: IAO_0000125
definition: x ends with y if and only if x has part y and the time point at which x ends is equivalent to the time point at which y ends. Formally: α(y) > α(x) ∧ ω(y) = ω(x), where α is a function that maps a process to a start point, and ω is a function that maps a process to an end point.
IAO_0000117: Chris Mungall
IAO_0000118: finished by
database_cross_reference: RO:0002230
has OBO namespace: external
has OBO namespace: uberon
id: ends_with
in subset: ro-eco
shorthand: ends_with

has end location
type: ObjectProperty
sub property of: has part that occurs in
domain: process
range: independent continuant
property chain axiom: ends with
property chain axiom: occurs in
IAO_0000114: IAO_0000125
definition: x 'has end location' y if and only if there exists some process z such that x 'ends with' z and z 'occurs in' y
IAO_0000117: Chris Mungall
IAO_0000118: ends with process that occurs in
in subset: ro-eco

has input
type: ObjectProperty
sub property of: has participant
inverse of: input of
domain: process
range: material entity
property chain axiom: starts with
IAO_0000114: IAO_0000125
definition: p has input c iff: p is a process, c is a material entity, c is a participant in p, c is present at the start of p, and the state of c is modified during p.
IAO_0000117: Chris Mungall
IAO_0000118: consumes
IAO_0000412: ro.owl
database_cross_reference: RO:0002233
has OBO namespace: external
id: has_input
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
in subset: ro-eco
shorthand: has_input

has output
type: ObjectProperty
sub property of: has participant
inverse of: output of
property chain axiom: ends with
IAO_0000114: IAO_0000125
definition: p has output c iff c is a participant in p, c is present at the end of p, and c is not present in the same state at the beginning of p.
IAO_0000117: Chris Mungall
IAO_0000118: produces
IAO_0000412: ro.owl
database_cross_reference: RO:0002234
has OBO namespace: external
id: has_output
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
in subset: ro-eco
shorthand: has_output

has exposure route
type: ObjectProperty
sub property of: related via exposure to
definition: A broad relationship between an exposure event or process and a process by which the exposure stressor comes into contact with the exposure receptor
IAO_0000119: ExO:0000055

has exposure transport path
type: ObjectProperty
sub property of: related via exposure to
definition: A broad relationship between an exposure event or process and the course takes from the source to the target.
IAO_0000119: http://purl.obolibrary.org/obo/ExO_0000004

related via exposure to
type: ObjectProperty
sub property of: causally related to
domain: RO_0002310
definition: Any relationship between an exposure event or process and any other entity.
IAO_0000232: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving exposure events or processes.

has developmental contribution from
type: ObjectProperty
sub property of: developmentally preceded by
inverse of: developmentally contributes to
domain: anatomical entity
range: anatomical entity
property chain axiom: has part
property chain axiom: develops from
IAO_0000112: Mammalian thymus has developmental contribution from some pharyngeal pouch 3; Mammalian thymus has developmental contribution from some pharyngeal pouch 4 [Kardong]
IAO_0000114: IAO_0000125
definition: x has developmental contribution from y iff x has some part z such that z develops from y
IAO_0000117: Chris Mungall

developmentally contributes to
type: ObjectProperty
sub property of: developmentally succeeded by
sub property of: has potential to developmentally contribute to
property chain axiom: develops into
property chain axiom: part of
IAO_0000114: IAO_0000125
definition: inverse of has developmental contribution from
IAO_0000117: Chris Mungall
in subset: RO_0002259

developmentally preceded by
type: ObjectProperty
sub property of: developmentally related to
inverse of: developmentally succeeded by
domain: continuant
range: continuant
IAO_0000114: IAO_0000125
definition: Candidate definition: x developmentally related to y if and only if there exists some developmental process (GO:0032502) p such that x and y both participates in p, and x is the output of p and y is the input of p
editor note: false
IAO_0000117: Chris Mungall
IAO_0000232: In general you should not use this relation to make assertions - use one of the more specific relations below this one
comment: This relation groups together various other developmental relations. It is fairly generic, encompassing induction, developmental contribution and direct and transitive develops from

acts upstream of
type: ObjectProperty
sub property of: acts upstream of or within
property chain axiom: enables
property chain axiom: causally upstream of
IAO_0000112: A faulty traffic light (material entity) whose malfunctioning (a process) is causally upstream of a traffic collision (a process): the traffic light acts upstream of the collision.
definition: c acts upstream of p if and only if c enables some f that is involved in p' and p' occurs chronologically before p, is not part of p, and affects the execution of p. c is a material entity and f, p, p' are processes.
database_cross_reference: RO:0002263
in subset: valid for go gp2term
shorthand: acts_upstream_of

acts upstream of or within
type: ObjectProperty
sub property of: causal agent in process
property chain axiom: enables
property chain axiom: causally upstream of or within
IAO_0000112: A gene product that has some activity, where that activity may be a part of a pathway or upstream of the pathway.
definition: c acts upstream of or within p if c is enables f, and f is causally upstream of or within p. c is a material entity and p is an process.
database_cross_reference: RO:0002264
has related synonym: affects
in subset: valid for go gp2term
shorthand: acts_upstream_of_or_within

developmentally succeeded by
type: ObjectProperty
sub property of: has developmental potential involving
IAO_0000114: IAO_0000125
definition: Inverse of developmentally preceded by
IAO_0000117: Chris Mungall

part of developmental precursor of
type: ObjectProperty
sub property of: developmentally succeeded by
property chain axiom: part of
property chain axiom: directly develops into
IAO_0000112: 'hypopharyngeal eminence' SubClassOf 'part of precursor of' some tongue
IAO_0000114: IAO_0000125
IAO_0000117: Chris Mungall

results in developmental progression of
type: ObjectProperty
sub property of: developmentally related to
domain: GO_0008150
range: anatomical entity
range: anatomical structure
IAO_0000114: IAO_0000125
definition: p results in the developmental progression of s iff p is a developmental process and s is an anatomical entity and p causes s to undergo a change in state at some point along its natural developmental cycle (this cycle starts with its formation, through the mature structure, and ends with its loss).
definition: p results in the developmental progression of s iff p is a developmental process and s is an anatomical structure and p causes s to undergo a change in state at some point along its natural developmental cycle (this cycle starts with its formation, through the mature structure, and ends with its loss).
editor note: This property and its subproperties are being used primarily for the definition of GO developmental processes. The property hierarchy mirrors the core GO hierarchy. In future we may be able to make do with a more minimal set of properties, but due to the way GO is currently structured we require highly specific relations to avoid incorrect entailments. To avoid this, the corresponding genus terms in GO should be declared mutually disjoint.
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002295
has OBO namespace: external
id: results_in_developmental_progression_of
shorthand: results_in_developmental_progression_of

results in formation of
type: ObjectProperty
sub property of: has output
sub property of: results in developmental progression of
inverse of: formed as result of
IAO_0000112: an annotation of gene X to anatomical structure formation with results_in_formation_of UBERON:0000007 (pituitary gland) means that at the beginning of the process a pituitary gland does not exist and at the end of the process a pituitary gland exists.
IAO_0000112: every "endocardial cushion formation" (GO:0003272) results_in_formation_of some "endocardial cushion" (UBERON:0002062)
IAO_0000114: IAO_0000125
IAO_0000117: Chris Mungall
IAO_0000119: GOC:mtg_berkeley_2013
database_cross_reference: RO:0002297
has OBO namespace: external
id: results_in_formation_of
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
shorthand: results_in_formation_of

has habitat
type: ObjectProperty
sub property of: ecologically related to
domain: organism or virus or viroid
range: ENVO_01000254
IAO_0000112: Hydrozoa (NCBITaxon_6074) SubClassOf 'has habitat' some 'Hydrozoa habitat' where 'Hydrozoa habitat' SubClassOf overlaps some ('marine environment' (ENVO_00000569) and 'freshwater environment' (ENVO_01000306) and 'wetland' (ENVO_00000043)) and 'has part' some (freshwater (ENVO_00002011) or 'sea water' (ENVO_00002149)) -- http://eol.org/pages/1795/overview
IAO_0000114: IAO_0000428
definition: x 'has habitat' y if and only if: x is an organism, y is a habitat, and y can sustain and allow the growth of a population of xs.
IAO_0000117: Pier Buttigieg
IAO_0000118: adapted for living in
in subset: ro-eco
comment: A population of xs will possess adaptations (either evolved naturally or via artifical selection) which permit it to exist and grow in y.

causally upstream of, positive effect
type: ObjectProperty
sub property of: causally upstream of
sub property of: causally upstream of or within, positive effect
definition: p is causally upstream of, positive effect q iff p is casually upstream of q, and the execution of p is required for the execution of q.
RO_0004049: causally upstream of
creator: cjm
database_cross_reference: RO:0002304
has OBO namespace: external
id: causally_upstream_of,_positive_effect
in subset: valid for go annotation extension
in subset: valid for gocam
shorthand: causally_upstream_of,_positive_effect
comment: holds between x and y if and only if x is causally upstream of y and the progression of x increases the frequency, rate or extent of y

causally upstream of, negative effect
type: ObjectProperty
sub property of: causally upstream of
sub property of: causally upstream of or within, negative effect
definition: p is causally upstream of, negative effect q iff p is casually upstream of q, and the execution of p decreases the execution of q.
RO_0004050: causally upstream of
creator: cjm
database_cross_reference: RO:0002305
has OBO namespace: external
id: causally_upstream_of,_negative_effect
in subset: valid for go annotation extension
in subset: valid for gocam
shorthand: causally_upstream_of,_negative_effect
comment: holds between x and y if and only if x is causally upstream of y and the progression of x decreases the frequency, rate or extent of y

has exposure stimulus
type: ObjectProperty
sub property of: related via exposure to
definition: A relationship between an exposure event or process and any agent, stimulus, activity, or event that causally effects an organism and interacts with an exposure receptor during an exposure event.
contributor: Austin Meier
contributor: Chris Mungall
contributor: Marie Angelique Laporte
created by: cjm
creation date: 2017-06-05T17:35:04Z

characteristic of part of
type: ObjectProperty
sub property of: depends on
property chain axiom: characteristic of
property chain axiom: part of
definition: q characteristic of part of w if and only if there exists some p such that q inheres in p and p part of w.
definition: q inheres in part of w if and only if there exists some p such that q inheres in p and p part of w.
editor note: Because part_of is transitive, inheres in is a sub-relation of characteristic of part of
editor note: Because part_of is transitive, inheres in is a sub-relation of inheres in part of
IAO_0000117: Chris Mungall
IAO_0000118: inheres in part of
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/20064205
RO_0001900: RO_0001901
database_cross_reference: RO:0002314
shorthand: characteristic_of_part_of
label: inheres in part of

Axiom
annotated source: characteristic of part of
annotated property: propertyChainAxiom
annotated target: characteristic of
annotated target: part of
RO_0002582: true

evolutionarily related to
type: ObjectProperty
definition: A relationship that holds via some environmental process
IAO_0000117: Chris Mungall
IAO_0000232: Do not use this relation directly. It is ended as a grouping for a diverse set of relations, all involving the process of evolution.
database_cross_reference: RO:0002320
shorthand: evolutionarily_related_to

ecologically related to
type: ObjectProperty
definition: A relationship that is mediated in some way by the environment or environmental feature (ENVO:00002297)
editor note: Awaiting class for domain/range constraint, see: https://github.com/OBOFoundry/Experimental-OBO-Core/issues/6
IAO_0000117: Chris Mungall
IAO_0000232: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving ecological interactions
in subset: ro-eco

mereotopologically related to
type: ObjectProperty
definition: A mereological relationship or a topological relationship
IAO_0000117: Chris Mungall
IAO_0000232: Do not use this relation directly. It is ended as a grouping for a diverse set of relations, all involving parthood or connectivity relationships
RO_0001900: RO_0001901
database_cross_reference: RO:0002323
shorthand: mereotopologically_related_to

developmentally related to
type: ObjectProperty
definition: A relationship that holds between entities participating in some developmental process (GO:0032502)
IAO_0000117: Chris Mungall
IAO_0000232: Do not use this relation directly. It is ended as a grouping for a diverse set of relations, all involving organismal development
database_cross_reference: RO:0002324
shorthand: developmentally_related_to

enables
type: ObjectProperty
sub property of: capable of
inverse of: enabled by
property chain axiom: has part
property chain axiom: has component activity
IAO_0000112: a particular instances of akt-2 enables some instance of protein kinase activity
definition: c enables p iff c is capable of p and c acts to execute p.
IAO_0000117: Chris Mungall
IAO_0000118: catalyzes
IAO_0000118: executes
IAO_0000118: has
IAO_0000118: is catalyzing
IAO_0000118: is executing
IAO_0000232: This relation differs from the parent relation 'capable of' in that the parent is weaker and only expresses a capability that may not be actually realized, whereas this relation is always realized.
IAO_0000232: This relation is currently used experimentally by the Gene Ontology Consortium. It may not be stable and may be obsoleted at some future time.
database_cross_reference: RO:0002327
in subset: valid for go gp2term
shorthand: enables

functionally related to
type: ObjectProperty
definition: A grouping relationship for any relationship directly involving a function, or that holds because of a function of one of the related entities.
IAO_0000117: Chris Mungall
IAO_0000232: This is a grouping relation that collects relations used for the purpose of connecting structure and function
database_cross_reference: RO:0002328
has OBO namespace: uberon
id: functionally_related_to
shorthand: functionally_related_to

part of structure that is capable of
type: ObjectProperty
sub property of: functionally related to
property chain axiom: part of
property chain axiom: capable of
definition: this relation holds between c and p when c is part of some c', and c' is capable of p.
IAO_0000117: Chris Mungall
IAO_0000118: false
database_cross_reference: RO:0002329
shorthand: part_of_structure_that_is_capable_of

Axiom
annotated source: part of structure that is capable of
annotated property: propertyChainAxiom
annotated target: part of
annotated target: capable of
is a defining property chain axiom: true

involved in
type: ObjectProperty
sub property of: participates in
sub property of: involved in or involved in regulation of
property chain axiom: enables
property chain axiom: part of
definition: c involved_in p if and only if c enables some process p', and p' is part of p
IAO_0000117: Chris Mungall
IAO_0000118: actively involved in
IAO_0000118: enables part of
database_cross_reference: RO:0002331
shorthand: involved_in

enabled by
type: ObjectProperty
sub property of: has participant
sub property of: functionally related to
definition: inverse of enables
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002333
in subset: valid for gocam
shorthand: enabled_by

regulated by
type: ObjectProperty
sub property of: causally downstream of or within
type: TransitiveProperty
domain: process
range: process
definition: inverse of regulates
IAO_0000117: Chris Mungall
IAO_0000589: regulated by (processual)
database_cross_reference: RO:0002334
has OBO namespace: external
id: regulated_by
in subset: RO_0002259
shorthand: regulated_by

negatively regulated by
type: ObjectProperty
sub property of: regulated by
definition: inverse of negatively regulates
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002335
has OBO namespace: external
id: negatively_regulated_by
in subset: RO_0002259
shorthand: negatively_regulated_by

positively regulated by
type: ObjectProperty
sub property of: regulated by
definition: inverse of positively regulates
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002336
has OBO namespace: external
id: positively_regulated_by
in subset: RO_0002259
shorthand: positively_regulated_by

member of
type: ObjectProperty
sub property of: part of
inverse of: has member
IAO_0000112: An organism that is a member of a population of organisms
definition: is member of is a mereological relation between a item and a collection.
IAO_0000118: is member of
IAO_0000118: member part of
IAO_0000119: SIO
IAO_0000412: ro.owl
RO_0001900: RO_0001901

has member
type: ObjectProperty
sub property of: has part
type: IrreflexiveProperty
definition: has member is a mereological relation between a collection and an item.
IAO_0000119: SIO
IAO_0000412: ro.owl
RO_0001900: RO_0001901

input of
type: ObjectProperty
sub property of: participates in
sub property of: functionally related to
definition: inverse of has input
IAO_0000117: Chris Mungall
IAO_0000412: ro.owl
database_cross_reference: RO:0002352
has OBO namespace: uberon
id: input_of
in subset: RO_0002259
in subset: ro-eco
shorthand: input_of

output of
type: ObjectProperty
sub property of: participates in
sub property of: functionally related to
definition: inverse of has output
IAO_0000117: Chris Mungall
IAO_0000412: ro.owl
database_cross_reference: RO:0002353
has OBO namespace: external
has OBO namespace: uberon
id: output_of
in subset: RO_0002259
in subset: ro-eco
shorthand: output_of

formed as result of
type: ObjectProperty
sub property of: output of
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002354
shorthand: formed_as_result_of

spatially coextensive with
type: ObjectProperty
sub property of: overlaps
property chain axiom: located_in
property chain axiom:
  inverse of: located_in
IAO_0000112: A lump of clay and a statue
definition: x spatially_coextensive_with y if and inly if x and y have the same location
IAO_0000117: Chris Mungall
IAO_0000232: This relation is added for formal completeness. It is unlikely to be used in many practical scenarios

has developmental potential involving
type: ObjectProperty
sub property of: developmentally related to
domain: anatomical entity
range: anatomical entity
IAO_0000114: IAO_0000428
definition: x has developmental potential involving y iff x is capable of a developmental process with output y. y may be the successor of x, or may be a different structure in the vicinity (as for example in the case of developmental induction).
IAO_0000117: Chris Mungall

has potential to developmentally contribute to
type: ObjectProperty
sub property of: has developmental potential involving
IAO_0000114: IAO_0000428
definition: x has potential to developmentrally contribute to y iff x developmentally contributes to y or x is capable of developmentally contributing to y
IAO_0000117: Chris Mungall

has potential to develop into
type: ObjectProperty
sub property of: has developmental potential involving
IAO_0000114: IAO_0000428
definition: x has the potential to develop into y iff x develops into y or if x is capable of developing into y
IAO_0000117: Chris Mungall

has potential to directly develop into
type: ObjectProperty
sub property of: has potential to develop into
IAO_0000114: IAO_0000428
definition: x has potential to directly develop into y iff x directly develops into y or x is capable of directly developing into y
IAO_0000117: Chris Mungall

causally downstream of
type: ObjectProperty
sub property of: preceded by
sub property of: causally downstream of or within
inverse of: causally upstream of
IAO_0000114: IAO_0000428
definition: inverse of upstream of
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002404
has OBO namespace: external
id: causally_downstream_of
shorthand: causally_downstream_of

immediately causally downstream of
type: ObjectProperty
sub property of: immediately preceded by
sub property of: causally downstream of
inverse of: immediately causally upstream of
IAO_0000114: IAO_0000428
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002405
has OBO namespace: external
id: immediately_causally_downstream_of
shorthand: immediately_causally_downstream_of

indirectly positively regulates
type: ObjectProperty
sub property of: positively regulates
sub property of: indirectly regulates
type: TransitiveProperty
property chain axiom: directly positively regulates
property chain axiom: indirectly negatively regulates
definition: p indirectly positively regulates q iff p is indirectly causally upstream of q and p positively regulates q.
IAO_0000117: Chris Mungall
IAO_0000118: indirectly activates
RO_0002579: positively regulates
database_cross_reference: RO:0002407
shorthand: indirectly_positively_regulates

indirectly negatively regulates
type: ObjectProperty
sub property of: negatively regulates
sub property of: indirectly regulates
type: TransitiveProperty
property chain axiom: directly negatively regulates
definition: p indirectly negatively regulates q iff p is indirectly causally upstream of q and p negatively regulates q.
IAO_0000117: Chris Mungall
IAO_0000118: indirectly inhibits
RO_0002579: negatively regulates
database_cross_reference: RO:0002409
shorthand: indirectly_negatively_regulates

causally related to
type: ObjectProperty
IAO_0000114: IAO_0000428
definition: This relation groups causal relations between material entities and causal relations between processes
definition: relation that links two events, processes, states, or objects such that one event, process, state, or object (a cause) contributes to the production of another event, process, state, or object (an effect) where the cause is partly or wholly responsible for the effect, and the effect is partly or wholly dependent on the cause.
editor note: This branch of the ontology deals with causal relations between entities. It is divided into two branches: causal relations between occurrents/processes, and causal relations between material entities. We take an 'activity flow-centric approach', with the former as primary, and define causal relations between material entities in terms of causal relations between occurrents. To define causal relations in an activity-flow type network, we make use of 3 primitives: * Temporal: how do the intervals of the two occurrents relate? * Is the causal relation regulatory? * Is the influence positive or negative The first of these can be formalized in terms of the Allen Interval Algebra. Informally, the 3 bins we care about are 'direct', 'indirect' or overlapping. Note that all causal relations should be classified under a RO temporal relation (see the branch under 'temporally related to'). Note that all causal relations are temporal, but not all temporal relations are causal. Two occurrents can be related in time without being causally connected. We take causal influence to be primitive, elucidated as being such that has the upstream changed, some qualities of the donwstream would necessarily be modified. For the second, we consider a relationship to be regulatory if the system in which the activities occur is capable of altering the relationship to achieve some objective. This could include changing the rate of production of a molecule. For the third, we consider the effect of the upstream process on the output(s) of the downstream process. If the level of output is increased, or the rate of production of the output is increased, then the direction is increased. Direction can be positive, negative or neutral or capable of either direction. Two positives in succession yield a positive, two negatives in succession yield a positive, otherwise the default assumption is that the net effect is canceled and the influence is neutral. Each of these 3 primitives can be composed to yiel…
editor note: This branch of the ontology deals with causal relations between entities. It is divided into two branches: causal relations between occurrents/processes, and causal relations between material entities. We take an 'activity flow-centric approach', with the former as primary, and define causal relations between material entities in terms of causal relations between occurrents. To define causal relations in an activity-flow type network, we make use of 3 primitives: * Temporal: how do the intervals of the two occurrents relate? * Is the causal relation regulatory? * Is the influence positive or negative? The first of these can be formalized in terms of the Allen Interval Algebra. Informally, the 3 bins we care about are 'direct', 'indirect' or overlapping. Note that all causal relations should be classified under a RO temporal relation (see the branch under 'temporally related to'). Note that all causal relations are temporal, but not all temporal relations are causal. Two occurrents can be related in time without being causally connected. We take causal influence to be primitive, elucidated as being such that has the upstream changed, some qualities of the donwstream would necessarily be modified. For the second, we consider a relationship to be regulatory if the system in which the activities occur is capable of altering the relationship to achieve some objective. This could include changing the rate of production of a molecule. For the third, we consider the effect of the upstream process on the output(s) of the downstream process. If the level of output is increased, or the rate of production of the output is increased, then the direction is increased. Direction can be positive, negative or neutral or capable of either direction. Two positives in succession yield a positive, two negatives in succession yield a positive, otherwise the default assumption is that the net effect is canceled and the influence is neutral. Each of these 3 primitives can be composed to yie…
IAO_0000117: Chris Mungall
IAO_0000232: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving cause and effect.
database_cross_reference: RO:0002410
shorthand: causally_related_to

Axiom
annotated source: causally related to
annotated property: definition
annotated target: relation that links two events, processes, states, or objects such that one event, process, state, or object (a cause) contributes to the production of another event, process, state, or object (an effect) where the cause is partly or wholly responsible for the effect, and the effect is partly or wholly dependent on the cause.
database_cross_reference: https://en.wikipedia.org/wiki/Causality

causally upstream of
type: ObjectProperty
sub property of: precedes
sub property of: causally upstream of or within
type: TransitiveProperty
IAO_0000114: IAO_0000428
definition: p is causally upstream of q if and only if p precedes q and p and q are linked in a causal chain
definition: p is causally upstream of q iff p is causally related to q, the end of p precedes the end of q, and p is not an occurrent part of q.
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002411
has OBO namespace: external
id: causally_upstream_of
in subset: valid for go annotation extension
in subset: valid for gocam
shorthand: causally_upstream_of

immediately causally upstream of
type: ObjectProperty
sub property of: immediately precedes
sub property of: causally upstream of
IAO_0000114: IAO_0000428
definition: p is immediately causally upstream of q iff both (a) p immediately precedes q and (b) p is causally upstream of q. In addition, the output of p must be an input of q.
definition: p is immediately causally upstream of q iff p is causally upstream of q, and the end of p is coincident with the beginning of q.
IAO_0000117: Chris Mungall
RO_0002575: causally upstream of
database_cross_reference: RO:0002412
has OBO namespace: external
id: immediately_causally_upstream_of
shorthand: immediately_causally_upstream_of

causally upstream of or within
type: ObjectProperty
sub property of: causal relation between processes
inverse of: causally downstream of or within
type: TransitiveProperty
definition: p 'causally upstream or within' q iff (1) the end of p is before the end of q and (2) the execution of p exerts some causal influence over the outputs of q; i.e. if p was abolished or the outputs of p were to be modified, this would necessarily affect q.
definition: p is 'causally upstream or within' q iff p is causally related to q, and the end of p precedes, or is coincident with, the end of q.
editor note: We would like to make this disjoint with 'preceded by', but this is prohibited in OWL2
IAO_0000117: Chris Mungall
IAO_0000118: influences (processual)
database_cross_reference: RO:0002418
has OBO namespace: external
has related synonym: affects
id: causally_upstream_of_or_within
shorthand: causally_upstream_of_or_within

causally downstream of or within
type: ObjectProperty
sub property of: causal relation between processes
type: TransitiveProperty
definition: inverse of causally upstream of or within
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
database_cross_reference: RO:0002427
has OBO namespace: external
id: causally_downstream_of_or_within
in subset: RO_0002259
shorthand: causally_downstream_of_or_within

involved in regulation of
type: ObjectProperty
sub property of: acts upstream of
sub property of: involved in or involved in regulation of
property chain axiom: enables
property chain axiom: regulates
property chain axiom: involved in
definition: c involved in regulation of p if c is involved in some p' and p' regulates some p
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002428
shorthand: involved_in_regulation_of

involved in positive regulation of
type: ObjectProperty
sub property of: involved in regulation of
property chain axiom: enables
property chain axiom: positively regulates
property chain axiom: involved in
definition: c involved in regulation of p if c is involved in some p' and p' positively regulates some p
IAO_0000117: Chris Mungall
RO_0004049: involved in regulation of
database_cross_reference: RO:0002429
shorthand: involved_in_positive_regulation_of

involved in negative regulation of
type: ObjectProperty
sub property of: involved in regulation of
property chain axiom: enables
property chain axiom: negatively regulates
property chain axiom: involved in
definition: c involved in regulation of p if c is involved in some p' and p' negatively regulates some p
IAO_0000117: Chris Mungall
RO_0004050: involved in regulation of
database_cross_reference: RO:0002430
shorthand: involved_in_negative_regulation_of

involved in or involved in regulation of
type: ObjectProperty
sub property of: acts upstream of or within
sub property of: functionally related to
sub property of: causal agent in process
definition: c involved in or regulates p if and only if either (i) c is involved in p or (ii) c is involved in regulation of p
editor note: OWL does not allow defining object properties via a Union
IAO_0000117: Chris Mungall
IAO_0000118: involved in or reguates
database_cross_reference: RO:0002431
shorthand: involved_in_or_involved_in_regulation_of

is active in
type: ObjectProperty
sub property of: overlaps
sub property of: functionally related to
property chain axiom: enables
property chain axiom: occurs in
IAO_0000112: A protein that enables activity in a cytosol.
definition: c executes activity in d if and only if c enables p and p occurs_in d. Assuming no action at a distance by gene products, if a gene product enables (is capable of) a process that occurs in some structure, it must have at least some part in that structure.
IAO_0000117: Chris Mungall
IAO_0000118: executes activity in
has exact synonym: enables activity in

Axiom
annotated source: is active in
annotated property: propertyChainAxiom
annotated target: enables
annotated target: occurs in
is a defining property chain axiom: true

Axiom
annotated source: is active in
annotated property: definition
annotated target: c executes activity in d if and only if c enables p and p occurs_in d. Assuming no action at a distance by gene products, if a gene product enables (is capable of) a process that occurs in some structure, it must have at least some part in that structure.
database_cross_reference: GOC:cjm
database_cross_reference: GOC:dos

interacts with
type: ObjectProperty
type: SymmetricProperty
domain: material entity
range: material entity
definition: A relationship that holds between two entities in which the processes executed by the two entities are causally connected.
editor note: Considering relabeling as 'pairwise interacts with'
editor note: This relation and all sub-relations can be applied to either (1) pairs of entities that are interacting at any moment of time (2) populations or species of entity whose members have the disposition to interact (3) classes whose members have the disposition to interact.
IAO_0000117: Chris Mungall
IAO_0000232: Note that this relationship type, and sub-relationship types may be redundant with process terms from other ontologies. For example, the symbiotic relationship hierarchy parallels GO. The relations are provided as a convenient shortcut. Consider using the more expressive processual form to capture your data. In the future, these relations will be linked to their cognate processes through rules.
database_cross_reference: RO:0002434
has exact synonym: in pairwise interaction with
has OBO namespace: source
id: interacts_with
in subset: ro-eco
shorthand: interacts_with

molecularly interacts with
type: ObjectProperty
sub property of: interacts with
type: SymmetricProperty
definition: An interaction relationship in which the two partners are molecular entities that directly physically interact with each other for example via a stable binding interaction or a brief interaction during which one modifies the other.
IAO_0000117: Chris Mungall
IAO_0000118: binds
IAO_0000118: molecularly binds with
database_cross_reference: RO:0002436
shorthand: molecularly_interacts_with

phosphorylates
type: ObjectProperty
sub property of: molecularly interacts with
editor note: Axiomatization to GO to be added later
IAO_0000117: Chris Mungall
IAO_0000118: An interaction relation between x and y in which x catalyzes a reaction in which a phosphate group is added to y.
database_cross_reference: RO:0002447
shorthand: phosphorylates

directly regulates activity of
type: ObjectProperty
sub property of: molecularly interacts with
sub property of: regulates activity of
domain: material entity
range: material entity
property chain axiom: enables
property chain axiom: regulates
property chain axiom: enabled by
definition: The entity A, immediately upstream of the entity B, has an activity that regulates an activity performed by B. For example, A and B may be gene products and binding of B by A regulates the kinase activity of B. A and B can be physically interacting but not necessarily. Immediately upstream means there are no intermediate entity between A and B.
IAO_0000117: Chris Mungall
IAO_0000117: Vasundra Touré
database_cross_reference: RO:0002448
has exact synonym: molecularly controls
shorthand: directly_regulates_activity_of

directly negatively regulates activity of
type: ObjectProperty
sub property of: directly regulates activity of
domain: material entity
range: material entity
property chain axiom: enables
property chain axiom: directly negatively regulates
property chain axiom: enabled by
definition: The entity A, immediately upstream of the entity B, has an activity that negatively regulates an activity performed by B. For example, A and B may be gene products and binding of B by A negatively regulates the kinase activity of B.
IAO_0000117: Chris Mungall
IAO_0000117: Vasundra Touré
IAO_0000118: directly inhibits
database_cross_reference: RO:0002449
has exact synonym: molecularly decreases activity of
shorthand: directly_negatively_regulates_activity_of

directly positively regulates activity of
type: ObjectProperty
sub property of: directly regulates activity of
domain: material entity
range: material entity
property chain axiom: enables
property chain axiom: directly positively regulates
property chain axiom: enabled by
definition: The entity A, immediately upstream of the entity B, has an activity that positively regulates an activity performed by B. For example, A and B may be gene products and binding of B by A positively regulates the kinase activity of B.
IAO_0000117: Chris Mungall
IAO_0000117: Vasundra Touré
IAO_0000118: directly activates
database_cross_reference: RO:0002450
has exact synonym: molecularly increases activity of
shorthand: directly_positively_regulates_activity_of

helper property (not for use in curation)
type: ObjectProperty
IAO_0000117: Chris Mungall
IAO_0000232: This property or its subproperties is not to be used directly. These properties exist as helper properties that are used to support OWL reasoning.
database_cross_reference: RO:0002464
shorthand: helper_property_(not_for_use_in_curation)

composed primarily of
type: ObjectProperty
sub property of: has part
domain: material entity
range: material entity
IAO_0000112: 'otolith organ' SubClassOf 'composed primarily of' some 'calcium carbonate'
definition: x composed_primarily_of y if and only if more than half of the mass of x is made from y or units of the same type as y.
IAO_0000117: Chris Mungall
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/22293552
RO_0001900: RO_0001901
in subset: ro-eco

has part that occurs in
type: ObjectProperty
domain: occurrent
range: independent continuant
property chain axiom: has part
property chain axiom: occurs in
definition: p has part that occurs in c if and only if there exists some p1, such that p has_part p1, and p1 occurs in c.
IAO_0000117: Chris Mungall
in subset: ro-eco

Axiom
annotated source: has part that occurs in
annotated property: propertyChainAxiom
annotated target: has part
annotated target: occurs in
is a defining property chain axiom: true

is kinase activity
type: ObjectProperty
sub property of: molecular interaction relation helper property
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002481
shorthand: is_kinase_activity

transformation of
type: ObjectProperty
sub property of: develops from
type: TransitiveProperty
definition: x transformation of y if x is the immediate transformation of y, or is linked to y through a chain of transformation relationships
IAO_0000117: Chris Mungall

immediate transformation of
type: ObjectProperty
sub property of: directly develops from
sub property of: transformation of
definition: x immediate transformation of y iff x immediately succeeds y temporally at a time boundary t, and all of the matter present in x at t is present in y at t, and all the matter in y at t is present in x at t
IAO_0000117: Chris Mungall
RO_0002575: transformation of

causal agent in process
type: ObjectProperty
sub property of: causal relation between material entity and a process
inverse of: process has causal agent
definition: A relationship between a material entity and a process where the material entity has some causal role that influences the process
IAO_0000119: causal-relations
database_cross_reference: RO:0002500
shorthand: causal_agent_in_process

causal relation between processes
type: ObjectProperty
sub property of: causally related to
domain: occurrent
range: occurrent
definition: p is causally related to q if and only if p or any part of p and q or any part of q are linked by a chain of events where each event pair is one of direct activation or direct inhibition. p may be upstream, downstream, part of or a container of q.
definition: p is causally related to q if and only if p or any part of p and q or any part of q are linked by a chain of events where each event pair is one where the execution of p influences the execution of q. p may be upstream, downstream, part of, or a container of q.
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000232: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving cause and effect.
database_cross_reference: RO:0002501
shorthand: causal_relation_between_processes

depends on
type: ObjectProperty
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002502
shorthand: depends_on

causal relation between entities
type: ObjectProperty
sub property of: causally related to
domain: continuant
range: continuant
editor note: The intent is that the process branch of the causal property hierarchy is primary (causal relations hold between occurrents/processes), and that the material branch is defined in terms of the process branch
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000232: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving cause and effect.
database_cross_reference: RO:0002506
shorthand: causal_relation_between_entities

determined by
type: ObjectProperty
sub property of: part of
sub property of: determined by part of
sub property of: causally influenced by
inverse of: determines
domain: RO_0002577
range: material entity
IAO_0000112: A coral reef environment is determined by a particular coral reef
definition: s determined by f if and only if s is a type of system, and f is a material entity that is part of s, such that f exerts a strong causal influence on the functioning of s, and the removal of f would cause the collapse of s.
editor note: The label for this relation is probably too general for its restricted use, where the domain is a system. It may be relabeled in future
IAO_0000117: Chris Mungall
IAO_0000119: http://www.ncbi.nlm.nih.gov/pubmed/24330602
IAO_0000589: determined by (system to material entity)
creator: Chris Mungall
creator: Pier Buttigieg
in subset: ro-eco

determines
type: ObjectProperty
sub property of: causally influences
definition: inverse of determined by
IAO_0000117: Chris Mungall
IAO_0000589: determines (material entity to system)
in subset: RO_0002259
in subset: ro-eco

determined by part of
type: ObjectProperty
sub property of: overlaps
sub property of: causal relation between entities
domain: RO_0002577
range: material entity
property chain axiom: determined by
property chain axiom: part of
definition: s 'determined by part of' w if and only if there exists some f such that (1) s 'determined by' f and (2) f part_of w, or f=w.
IAO_0000117: Chris Mungall
in subset: ro-eco

Axiom
annotated source: determined by part of
annotated property: propertyChainAxiom
annotated target: determined by
annotated target: part of
RO_0002582: true

causally influenced by
type: ObjectProperty
sub property of: causal relation between entities
inverse of: causally influences
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000589: causally influenced by (entity-centric)
database_cross_reference: RO:0002559
shorthand: causally_influenced_by

interaction relation helper property
type: ObjectProperty
sub property of: helper property (not for use in curation)
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002563
shorthand: interaction_relation_helper_property

molecular interaction relation helper property
type: ObjectProperty
sub property of: interaction relation helper property
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002564
shorthand: molecular_interaction_relation_helper_property

causally influences
type: ObjectProperty
sub property of: causal relation between entities
domain: continuant
range: continuant
property chain axiom: enables
property chain axiom: causally upstream of
property chain axiom: has input
property chain axiom: enabled by
definition: The entity or characteristic A is causally upstream of the entity or characteristic B, A having an effect on B. An entity corresponds to any biological type of entity as long as a mass is measurable. A characteristic corresponds to a particular specificity of an entity (e.g., phenotype, shape, size).
IAO_0000117: Chris Mungall
IAO_0000117: Vasundra Touré
IAO_0000119: causal-relations
IAO_0000589: causally influences (entity-centric)
database_cross_reference: RO:0002566
shorthand: causally_influences

directly regulates
type: ObjectProperty
sub property of: regulates
sub property of: immediately causally upstream of
definition: Process(P1) directly regulates process(P2) iff: P1 regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding regulates the kinase activity (P2) of protein B then P1 directly regulates P2.
definition: p directly regulates q iff p is immediately causally upstream of q and p regulates q.
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
IAO_0000589: directly regulates (processual)
RO_0002575: regulates
database_cross_reference: RO:0002578
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
shorthand: directly_regulates

has part structure that is capable of
type: ObjectProperty
sub property of: functionally related to
sub property of: causal relation between material entity and a process
property chain axiom: has part
property chain axiom: capable of
IAO_0000112: gland SubClassOf 'has part structure that is capable of' some 'secretion by cell'
definition: s 'has part structure that is capable of' p if and only if there exists some part x such that s 'has part' x and x 'capable of' p
IAO_0000117: Chris Mungall
database_cross_reference: RO:0002584
shorthand: has_part_structure_that_is_capable_of

results in breakdown of
type: ObjectProperty
sub property of: has input
definition: p results in breakdown of c if and only if the execution of p leads to c no longer being present at the end of p
database_cross_reference: RO:0002586
shorthand: results_in_breakdown_of

results in assembly of
type: ObjectProperty
sub property of: results in formation of
sub property of: results in organization of
database_cross_reference: RO:0002588
has OBO namespace: external
id: results_in_assembly_of
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
shorthand: results_in_assembly_of

results in disassembly of
type: ObjectProperty
sub property of: results in breakdown of
sub property of: results in organization of
database_cross_reference: RO:0002590
has OBO namespace: external
id: results_in_disassembly_of
shorthand: results_in_disassembly_of

results in organization of
type: ObjectProperty
sub property of: has participant
sub property of: results in changes to anatomical or cellular structure
definition: p results in organization of c iff p results in the assembly, arrangement of constituent parts, or disassembly of c
database_cross_reference: RO:0002592
has OBO namespace: external
id: results_in_organization_of
shorthand: results_in_organization_of

causal relation between material entity and a process
type: ObjectProperty
sub property of: causally related to
domain: material entity
range: process
definition: A relationship that holds between a material entity and a process in which causality is involved, with either the material entity or some part of the material entity exerting some influence over the process, or the process influencing some aspect of the material entity.
editor note: Do not use this relation directly. It is intended as a grouping for a diverse set of relations, all involving cause and effect.
IAO_0000117: Chris Mungall
IAO_0000119: causal-relations
database_cross_reference: RO:0002595
shorthand: causal_relation_between_material_entity_and_a_process

capable of regulating
type: ObjectProperty
sub property of: causal agent in process
property chain axiom: capable of
property chain axiom: regulates
IAO_0000112: pyrethroid -> growth
definition: Holds between c and p if and only if c is capable of some activity a, and a regulates p.
IAO_0000119: causal-relations
database_cross_reference: RO:0002596
shorthand: capable_of_regulating

capable of negatively regulating
type: ObjectProperty
sub property of: capable of regulating
property chain axiom: capable of
property chain axiom: negatively regulates
definition: Holds between c and p if and only if c is capable of some activity a, and a negatively regulates p.
IAO_0000119: causal-relations
database_cross_reference: RO:0002597
shorthand: capable_of_negatively_regulating

capable of positively regulating
type: ObjectProperty
sub property of: capable of regulating
property chain axiom: capable of
property chain axiom: positively regulates
IAO_0000112: renin -> arteriolar smooth muscle contraction
definition: Holds between c and p if and only if c is capable of some activity a, and a positively regulates p.
IAO_0000119: causal-relations
database_cross_reference: RO:0002598
shorthand: capable_of_positively_regulating

process has causal agent
type: ObjectProperty
sub property of: causally related to
definition: Inverse of 'causal agent in process'
IAO_0000119: causal-relations
database_cross_reference: RO:0002608
has OBO namespace: external
id: process_has_causal_agent
shorthand: process_has_causal_agent

directly positively regulates
type: ObjectProperty
sub property of: positively regulates
sub property of: directly regulates
definition: Process(P1) directly postively regulates process(P2) iff: P1 positively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding positively regulates the kinase activity (P2) of protein B then P1 directly positively regulates P2.
definition: p directly positively regulates q iff p is immediately causally upstream of q, and p positively regulates q.
IAO_0000119: causal-relations
IAO_0000589: directly positively regulates (process to process)
RO_0004049: directly regulates
database_cross_reference: RO:0002629
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
shorthand: directly_positively_regulates

directly negatively regulates
type: ObjectProperty
sub property of: negatively regulates
sub property of: directly regulates
definition: Process(P1) directly negatively regulates process(P2) iff: P1 negatively regulates P2 via direct physical interaction between an agent executing P1 (or some part of P1) and an agent executing P2 (or some part of P2). For example, if protein A has protein binding activity(P1) that targets protein B and this binding negatively regulates the kinase activity (P2) of protein B then P1 directly negatively regulates P2.
definition: p directly negatively regulates q iff p is immediately causally upstream of q, and p negatively regulates q.
IAO_0000119: causal-relations
IAO_0000589: directly negatively regulates (process to process)
RO_0004050: directly regulates
database_cross_reference: RO:0002630
in subset: valid for go annotation extension
in subset: valid for go ontology
in subset: valid for gocam
shorthand: directly_negatively_regulates

produces
type: ObjectProperty
inverse of: produced by
domain: material entity
range: material entity
property chain axiom:
  inverse of: occurs in
property chain axiom: has output
IAO_0000114: IAO_0000125
definition: a produces b if some process that occurs_in a has_output b, where a and b are material entities. Examples: hybridoma cell line produces monoclonal antibody reagent; chondroblast produces avascular GAG-rich matrix.
IAO_0000117: Melissa Haendel
in subset: ro-eco
comment: Note that this definition doesn't quite distinguish the output of a transformation process from a production process, which is related to the identity/granularity issue.

produced by
type: ObjectProperty
domain: material entity
range: material entity
IAO_0000114: IAO_0000125
definition: a produced_by b iff some process that occurs_in b has_output a.
IAO_0000117: Melissa Haendel
IAO_0000412: ro.owl
in subset: ro-eco

has primary input or output
type: ObjectProperty
sub property of: has participant
definition: p 'has primary input ot output' c iff either (a) p 'has primary input' c or (b) p 'has primary output' c.
created by: cjm
creation date: 2018-12-13T11:26:17Z
database_cross_reference: RO:0004007
has OBO namespace: external
id: has_primary_input_or_output
in subset: valid for go ontology
shorthand: has_primary_input_or_output

has primary output
type: ObjectProperty
sub property of: has output
sub property of: has primary input or output
definition: p has primary output c if (a) p has output c and (b) the goal of process is to modify, produce, or transform c.
created by: cjm
creation date: 2018-12-13T11:26:32Z
database_cross_reference: RO:0004008
has OBO namespace: external
id: has_primary_output
in subset: valid for go ontology
shorthand: has_primary_output

Axiom
annotated source: has primary output
annotated property: definition
annotated target: p has primary output c if (a) p has output c and (b) the goal of process is to modify, produce, or transform c.
database_cross_reference: GOC:cjm
database_cross_reference: GOC:dph
database_cross_reference: GOC:kva
database_cross_reference: GOC:pt
comment: PMID:27812932

realized in response to stimulus
type: ObjectProperty
sub property of: causally related to
domain: realizable entity
range: material entity
property chain axiom: realized in response to
property chain axiom: has input
definition: A relationship between a realizable entity R (e.g. function or disposition) and a material entity M where R is realized in response to a process that has an input stimulus of M.
created by: cjm
creation date: 2017-12-26T19:45:49Z

enables subfunction
type: ObjectProperty
sub property of: functionally related to
property chain axiom: enables
property chain axiom: has part
definition: Holds between an entity and an process P where the entity enables some larger compound process, and that larger process has-part P.
created by: cjm
creation date: 2018-01-25T23:20:13Z
database_cross_reference: RO:0004031
shorthand: enables_subfunction

acts upstream of or within, positive effect
type: ObjectProperty
sub property of: acts upstream of or within
property chain axiom: enables
property chain axiom: causally upstream of or within, positive effect
RO_0004049: acts upstream of or within
created by: cjm
creation date: 2018-01-26T23:49:30Z
database_cross_reference: RO:0004032
in subset: valid for go gp2term
shorthand: acts_upstream_of_or_within,_positive_effect

acts upstream of or within, negative effect
type: ObjectProperty
sub property of: acts upstream of or within
property chain axiom: enables
property chain axiom: causally upstream of or within, negative effect
RO_0004050: acts upstream of or within
created by: cjm
creation date: 2018-01-26T23:49:51Z
database_cross_reference: RO:0004033
in subset: valid for go gp2term
shorthand: acts_upstream_of_or_within,_negative_effect

acts upstream of, positive effect
type: ObjectProperty
sub property of: acts upstream of
sub property of: acts upstream of or within, positive effect
property chain axiom: enables
property chain axiom: causally upstream of, positive effect
definition: c 'acts upstream of, positive effect' p if c is enables f, and f is causally upstream of p, and the direction of f is positive
RO_0004049: acts upstream of
created by: cjm
creation date: 2018-01-26T23:53:14Z
database_cross_reference: RO:0004034
in subset: valid for go gp2term
shorthand: acts_upstream_of,_positive_effect

acts upstream of, negative effect
type: ObjectProperty
sub property of: acts upstream of
sub property of: acts upstream of or within, negative effect
property chain axiom: enables
property chain axiom: causally upstream of, negative effect
definition: c 'acts upstream of, negative effect' p if c is enables f, and f is causally upstream of p, and the direction of f is negative
RO_0004050: acts upstream of
created by: cjm
creation date: 2018-01-26T23:53:22Z
database_cross_reference: RO:0004035
in subset: valid for go gp2term
shorthand: acts_upstream_of,_negative_effect

causally upstream of or within, negative effect
type: ObjectProperty
sub property of: causally upstream of or within
RO_0004050: causally upstream of or within
created by: cjm
creation date: 2018-03-13T23:55:05Z
database_cross_reference: RO:0004046
shorthand: causally_upstream_of_or_within,_negative_effect

causally upstream of or within, positive effect
type: ObjectProperty
sub property of: causally upstream of or within
RO_0004049: causally upstream of or within
created by: cjm
creation date: 2018-03-13T23:55:19Z
database_cross_reference: RO:0004047
shorthand: causally_upstream_of_or_within,_positive_effect

has substance added
type: ObjectProperty
type: IrreflexiveProperty
IAO_0000114: IAO_0000428
definition: "has substance added" is a relation existing between a (physical) entity and a substance in which the entity has had the substance added to it at some point in time.
IAO_0000117: Damion Dooley
IAO_0000412: ro.owl

realized in response to
type: ObjectProperty
sub property of: causally related to
domain: realizable entity
range: process
property chain axiom: realized in
property chain axiom: causally downstream of
IAO_0000112: A drought sensitivity trait that inheres in a whole plant is realized in a systemic response process in response to exposure to drought conditions.
IAO_0000112: An inflammatory disease that is realized in response to an inflammatory process occurring in the gut (which is itself the realization of a process realized in response to harmful stimuli in the mucosal lining of th gut)
IAO_0000112: Environmental polymorphism in butterflies: These butterflies have a 'responsivity to day length trait' that is realized in response to the duration of the day, and is realized in developmental processes that lead to increased or decreased pigmentation in the adult morph.
definition: r 'realized in response to' s iff, r is a realizable (e.g. a plant trait such as responsivity to drought), s is an environmental stimulus (a process), and s directly causes the realization of r.
contributor: Austin Meier
contributor: Chris Mungall
contributor: David Osumi-Sutherland
contributor: Marie Angelique Laporte
has exact synonym: triggered by process

Axiom
annotated source: realized in response to
annotated property: has exact synonym
annotated target: triggered by process
database_cross_reference: RO:cjm

regulates activity of
type: ObjectProperty
sub property of: causally influences
domain: material entity
range: material entity
definition: The entity A has an activity that regulates an activity of the entity B. For example, A and B are gene products where the catalytic activity of A regulates the kinase activity of B.
IAO_0000117: Vasundra Touré
database_cross_reference: RO:0011002
shorthand: regulates_activity_of

indirectly causally upstream of
type: ObjectProperty
sub property of: causally upstream of
definition: p is indirectly causally upstream of q iff p is causally upstream of q and there exists some process r such that p is causally upstream of r and r is causally upstream of q.
created by: pg
creation date: 2022-09-26T06:07:17Z
database_cross_reference: RO:0012011
shorthand: indirectly_causally_upstream_of

indirectly regulates
type: ObjectProperty
sub property of: regulates
sub property of: indirectly causally upstream of
definition: p indirectly regulates q iff p is indirectly causally upstream of q and p regulates q.
created by: pg
creation date: 2022-09-26T06:08:01Z
database_cross_reference: RO:0012012
shorthand: indirectly_regulates

different in magnitude relative to
type: ObjectProperty
domain: PATO_0000001
range: PATO_0000001
definition: q1 different_in_magnitude_relative_to q2 if and only if magnitude(q1) NOT =~ magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.

Axiom
annotated source: different in magnitude relative to
annotated property: definition
annotated target: q1 different_in_magnitude_relative_to q2 if and only if magnitude(q1) NOT =~ magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: https://orcid.org/0000-0002-6601-2165

increased in magnitude relative to
type: ObjectProperty
sub property of: different in magnitude relative to
domain: PATO_0000001
range: PATO_0000001
definition: q1 increased_in_magnitude_relative_to q2 if and only if magnitude(q1) > magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
comment: This relation is used to determine the 'directionality' of relative qualities such as 'increased strength', relative to the parent type, 'strength'.

Axiom
annotated source: increased in magnitude relative to
annotated property: definition
annotated target: q1 increased_in_magnitude_relative_to q2 if and only if magnitude(q1) > magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: https://orcid.org/0000-0002-6601-2165

decreased in magnitude relative to
type: ObjectProperty
sub property of: different in magnitude relative to
domain: PATO_0000001
range: PATO_0000001
definition: q1 decreased_in_magnitude_relative_to q2 if and only if magnitude(q1) < magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
comment: This relation is used to determine the 'directionality' of relative qualities such as 'decreased strength', relative to the parent type, 'strength'.

Axiom
annotated source: decreased in magnitude relative to
annotated property: definition
annotated target: q1 decreased_in_magnitude_relative_to q2 if and only if magnitude(q1) < magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: https://orcid.org/0000-0002-6601-2165

reciprocal of
type: ObjectProperty
definition: q1 reciprocal_of q2 if and only if : q1 and q2 are relational qualities and a phenotype e q1 e2 mutually implies a phenotype e2 q2 e.
comment: There are frequently two ways to state the same thing: we can say 'spermatocyte lacks asters' or 'asters absent from spermatocyte'. In this case the quality is 'lacking all parts of type' - it is a (relational) quality of the spermatocyte, and it is with respect to instances of 'aster'. One of the popular requirements of PATO is that it continue to support 'absent', so we need to relate statements which use this quality to the 'lacking all parts of type' quality.

Axiom
annotated source: reciprocal of
annotated property: definition
annotated target: q1 reciprocal_of q2 if and only if : q1 and q2 are relational qualities and a phenotype e q1 e2 mutually implies a phenotype e2 q2 e.
database_cross_reference: https://orcid.org/0000-0002-6601-2165

has exposure medium
type: ObjectProperty
sub property of: related via exposure to
definition: X has exposure medium Y if X is an exposure event (process), Y is a material entity, and the stimulus for X is transmitted or carried in Y.
IAO_0000119: ExO:0000083
date: 2021-12-14T20:41:45Z
created by: https://orcid.org/0000-0002-7463-6306

device utilizes material
type: ObjectProperty
property chain axiom: capable of
property chain axiom: has input
IAO_0000112: A diagnostic testing device utilizes a specimen.
definition: X device utilizes material Y means X and Y are material entities, and X is capable of some process P that has input Y.
IAO_0000117: https://orcid.org/0000-0001-9625-1899
IAO_0000117: https://orcid.org/0000-0003-2620-0345
IAO_0000232: A diagnostic testing device utilizes a specimen means that the diagnostic testing device is capable of an assay, and this assay a specimen as its input.
IAO_0000232: See github ticket https://github.com/oborel/obo-relations/issues/497
creation date: 2021-11-08T12:00:00Z
has broad synonym: utilizes
database_cross_reference: RO:0017001
shorthand: device_utilizes_material

regulates characteristic
type: ObjectProperty
sub property of: causally related to
domain: process
range: PATO_0000001
property chain axiom: regulates
definition: A relationship that holds between a process and a characteristic in which process (P) regulates characteristic (C) iff: P results in the existence of C OR affects the intensity or magnitude of C.
contributor: https://orcid.org/0000-0002-8688-6599
database_cross_reference: RO:0019000
has OBO namespace: gene_ontology
id: regulates_characteristic
shorthand: regulates_characteristic

positively regulates characteristic
type: ObjectProperty
sub property of: regulates characteristic
property chain axiom: positively regulates
definition: A relationship that holds between a process and a characteristic in which process (P) positively regulates characteristic (C) iff: P results in an increase in the intensity or magnitude of C.
contributor: https://orcid.org/0000-0002-8688-6599
database_cross_reference: RO:0019001
has OBO namespace: gene_ontology
id: positively_regulates_characteristic
shorthand: positively_regulates_characteristic

negatively regulates characteristic
type: ObjectProperty
sub property of: regulates characteristic
property chain axiom: negatively regulates
property chain axiom: positively regulates characteristic
property chain axiom: positively regulates
definition: A relationship that holds between a process and a characteristic in which process (P) negatively regulates characteristic (C) iff: P results in a decrease in the intensity or magnitude of C.
contributor: https://orcid.org/0000-0002-8688-6599
database_cross_reference: RO:0019002
has OBO namespace: gene_ontology
id: negatively_regulates_characteristic
shorthand: negatively_regulates_characteristic

results in changes to anatomical or cellular structure
type: ObjectProperty
sub property of: has participant
definition: p has anatomical participant c iff p has participant c, and c is an anatomical entity
created by: cjm
creation date: 2018-09-26T01:08:58Z
database_cross_reference: RO:0040036
has OBO namespace: external
id: results_in_changes_to_anatomical_or_cellular_structure
shorthand: results_in_changes_to_anatomical_or_cellular_structure

has functional parent
type: ObjectProperty
has OBO namespace: chebi_ontology
id: has_functional_parent
is cyclic: false
is transitive: false

has parent hydride
type: ObjectProperty
has OBO namespace: chebi_ontology
id: has_parent_hydride
is cyclic: false
is transitive: false

is conjugate acid of
type: ObjectProperty
inverse of: is conjugate base of
has OBO namespace: chebi_ontology
id: is_conjugate_acid_of
is cyclic: true
is transitive: false

is conjugate base of
type: ObjectProperty
has OBO namespace: chebi_ontology
id: is_conjugate_base_of
is cyclic: true
is transitive: false

is enantiomer of
type: ObjectProperty
has OBO namespace: chebi_ontology
id: is_enantiomer_of
is cyclic: true
is transitive: false

is substituent group from
type: ObjectProperty
has OBO namespace: chebi_ontology
id: is_substituent_group_from
is cyclic: false
is transitive: false

interacts_with_an_exposure_receptor_via
type: ObjectProperty
has OBO namespace: source
id: interacts_with_an_exposure_receptor_via

interacts_with_an_exposure stressor_via
type: ObjectProperty
has OBO namespace: source
id: interacts_with_an_exposure_stressor_via

has_participant
type: ObjectProperty

decreased_in_magnitude_relative_to
type: ObjectProperty
sub property of: different_in_magnitude_relative_to
type: TransitiveProperty
domain: PATO_0000001
range: PATO_0000001
definition: q1 decreased_in_magnitude_relative_to q2 if and only if magnitude(q1) < magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
has OBO namespace: quality
id: decreased_in_magnitude_relative_to
comment: This relation is used to determine the 'directionality' of relative qualities such as 'decreased strength', relative to the parent type, 'strength'.

Axiom
annotated source: decreased_in_magnitude_relative_to
annotated property: definition
annotated target: q1 decreased_in_magnitude_relative_to q2 if and only if magnitude(q1) < magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: PATOC:CJM

different_in_magnitude_relative_to
type: ObjectProperty
domain: PATO_0000001
range: PATO_0000001
definition: q1 different_in_magnitude_relative_to q2 if and only if magnitude(q1) NOT =~ magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
has OBO namespace: quality
id: different_in_magnitude_relative_to

Axiom
annotated source: different_in_magnitude_relative_to
annotated property: definition
annotated target: q1 different_in_magnitude_relative_to q2 if and only if magnitude(q1) NOT =~ magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: PATOC:CJM

increased_in_magnitude_relative_to
type: ObjectProperty
sub property of: different_in_magnitude_relative_to
type: TransitiveProperty
domain: PATO_0000001
range: PATO_0000001
definition: q1 increased_in_magnitude_relative_to q2 if and only if magnitude(q1) > magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
has OBO namespace: quality
id: increased_in_magnitude_relative_to
comment: This relation is used to determine the 'directionality' of relative qualities such as 'increased strength', relative to the parent type, 'strength'.

Axiom
annotated source: increased_in_magnitude_relative_to
annotated property: definition
annotated target: q1 increased_in_magnitude_relative_to q2 if and only if magnitude(q1) > magnitude(q2). Here, magnitude(q) is a function that maps a quality to a unit-invariant scale.
database_cross_reference: PATOC:CJM

reciprocal_of
type: ObjectProperty
definition: q1 reciprocal_of q2 if and only if : q1 and q2 are relational qualities and a phenotype e q1 e2 mutually implies a phenotype e2 q2 e.
has OBO namespace: quality
id: reciprocal_of
comment: There are frequently two ways to state the same thing: we can say 'spermatocyte lacks asters' or 'asters absent from spermatocyte'. In this case the quality is 'lacking all parts of type' - it is a (relational) quality of the spermatocyte, and it is with respect to instances of 'aster'. One of the popular requirements of PATO is that it continue to support 'absent', so we need to relate statements which use this quality to the 'lacking all parts of type' quality.

Axiom
annotated source: reciprocal_of
annotated property: definition
annotated target: q1 reciprocal_of q2 if and only if : q1 and q2 are relational qualities and a phenotype e q1 e2 mutually implies a phenotype e2 q2 e.
database_cross_reference: PATOC:CJM

entity
type: Class
BFO_0000179: entity
BFO_0000180: Entity
IAO_0000112: Julius Caesar
IAO_0000112: Verdi’s Requiem
IAO_0000112: the Second World War
IAO_0000112: your body mass index
editor note: BFO 2 Reference: In all areas of empirical inquiry we encounter general terms of two sorts. First are general terms which refer to universals or types:animaltuberculosissurgical procedurediseaseSecond, are general terms used to refer to groups of entities which instantiate a given universal but do not correspond to the extension of any subuniversal of that universal because there is nothing intrinsic to the entities in question by virtue of which they – and only they – are counted as belonging to the given group. Examples are: animal purchased by the Emperortuberculosis diagnosed on a Wednesdaysurgical procedure performed on a patient from Stockholmperson identified as candidate for clinical trial #2056-555person who is signatory of Form 656-PPVpainting by Leonardo da VinciSuch terms, which represent what are called ‘specializations’ in [81
editor note: Entity doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. For example Werner Ceusters 'portions of reality' include 4 sorts, entities (as BFO construes them), universals, configurations, and relations. It is an open question as to whether entities as construed in BFO will at some point also include these other portions of reality. See, for example, 'How to track absolutely everything' at http://www.referent-tracking.com/_RTU/papers/CeustersICbookRevised.pdf
IAO_0000412: agro.owl
IAO_0000412: dron.owl
IAO_0000412: ecocore.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000600: An entity is anything that exists or has existed or will exist. (axiom label in BFO2 Reference: [001-001])

Axiom
annotated source: entity
annotated property: editor note
annotated target: Entity doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. For example Werner Ceusters 'portions of reality' include 4 sorts, entities (as BFO construes them), universals, configurations, and relations. It is an open question as to whether entities as construed in BFO will at some point also include these other portions of reality. See, for example, 'How to track absolutely everything' at http://www.referent-tracking.com/_RTU/papers/CeustersICbookRevised.pdf
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000004
comment: per discussion with Barry Smith

Axiom
annotated source: entity
annotated property: IAO_0000600
annotated target: An entity is anything that exists or has existed or will exist. (axiom label in BFO2 Reference: [001-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/001-001

continuant
type: Class
subclass of: entity
subclass of: Restriction
  on property: part of
  all values from: continuant
BFO_0000179: continuant
BFO_0000180: Continuant
IAO_0000111: continuant
definition: An entity that exists in full at any time in which it exists at all, persists through time while maintaining its identity and has no temporal parts.
editor note: BFO 2 Reference: Continuant entities are entities which can be sliced to yield parts only along the spatial dimension, yielding for example the parts of your table which we call its legs, its top, its nails. ‘My desk stretches from the window to the door. It has spatial parts, and can be sliced (in space) in two. With respect to time, however, a thing is a continuant.’ [60, p. 240
editor note: Continuant doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. For example, in an expansion involving bringing in some of Ceuster's other portions of reality, questions are raised as to whether universals are continuants
IAO_0000412: agro.owl
IAO_0000412: dron.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000600: A continuant is an entity that persists, endures, or continues to exist through time while maintaining its identity. (axiom label in BFO2 Reference: [008-002])
IAO_0000601: if b is a continuant and if, for some t, c has_continuant_part b at t, then c is a continuant. (axiom label in BFO2 Reference: [126-001])
IAO_0000601: if b is a continuant and if, for some t, cis continuant_part of b at t, then c is a continuant. (axiom label in BFO2 Reference: [009-002])
IAO_0000601: if b is a material entity, then there is some temporal interval (referred to below as a one-dimensional temporal region) during which b exists. (axiom label in BFO2 Reference: [011-002])
IAO_0000602: (forall (x y) (if (and (Continuant x) (exists (t) (continuantPartOfAt y x t))) (Continuant y))) // axiom label in BFO2 CLIF: [009-002]
IAO_0000602: (forall (x y) (if (and (Continuant x) (exists (t) (hasContinuantPartOfAt y x t))) (Continuant y))) // axiom label in BFO2 CLIF: [126-001]
IAO_0000602: (forall (x) (if (Continuant x) (Entity x))) // axiom label in BFO2 CLIF: [008-002]
IAO_0000602: (forall (x) (if (Material Entity x) (exists (t) (and (TemporalRegion t) (existsAt x t))))) // axiom label in BFO2 CLIF: [011-002]

Axiom
annotated source: continuant
annotated property: editor note
annotated target: Continuant doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. For example, in an expansion involving bringing in some of Ceuster's other portions of reality, questions are raised as to whether universals are continuants
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000007

Axiom
annotated source: continuant
annotated property: IAO_0000600
annotated target: A continuant is an entity that persists, endures, or continues to exist through time while maintaining its identity. (axiom label in BFO2 Reference: [008-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/008-002

Axiom
annotated source: continuant
annotated property: IAO_0000601
annotated target: if b is a continuant and if, for some t, c has_continuant_part b at t, then c is a continuant. (axiom label in BFO2 Reference: [126-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/126-001

Axiom
annotated source: continuant
annotated property: IAO_0000601
annotated target: if b is a continuant and if, for some t, cis continuant_part of b at t, then c is a continuant. (axiom label in BFO2 Reference: [009-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/009-002

Axiom
annotated source: continuant
annotated property: IAO_0000601
annotated target: if b is a material entity, then there is some temporal interval (referred to below as a one-dimensional temporal region) during which b exists. (axiom label in BFO2 Reference: [011-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/011-002

Axiom
annotated source: continuant
annotated property: IAO_0000602
annotated target: (forall (x y) (if (and (Continuant x) (exists (t) (continuantPartOfAt y x t))) (Continuant y))) // axiom label in BFO2 CLIF: [009-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/009-002

Axiom
annotated source: continuant
annotated property: IAO_0000602
annotated target: (forall (x y) (if (and (Continuant x) (exists (t) (hasContinuantPartOfAt y x t))) (Continuant y))) // axiom label in BFO2 CLIF: [126-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/126-001

Axiom
annotated source: continuant
annotated property: IAO_0000602
annotated target: (forall (x) (if (Continuant x) (Entity x))) // axiom label in BFO2 CLIF: [008-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/008-002

Axiom
annotated source: continuant
annotated property: IAO_0000602
annotated target: (forall (x) (if (Material Entity x) (exists (t) (and (TemporalRegion t) (existsAt x t))))) // axiom label in BFO2 CLIF: [011-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/011-002

occurrent
type: Class
subclass of: entity
subclass of: Restriction
  on property: part of
  all values from: occurrent
BFO_0000179: occurrent
BFO_0000180: Occurrent
definition: An entity that has temporal parts and that happens, unfolds or develops through time.
editor note: BFO 2 Reference: every occurrent that is not a temporal or spatiotemporal region is s-dependent on some independent continuant that is not a spatial region
editor note: BFO 2 Reference: s-dependence obtains between every process and its participants in the sense that, as a matter of necessity, this process could not have existed unless these or those participants existed also. A process may have a succession of participants at different phases of its unfolding. Thus there may be different players on the field at different times during the course of a football game; but the process which is the entire game s-depends_on all of these players nonetheless. Some temporal parts of this process will s-depend_on on only some of the players.
editor note: Occurrent doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. An example would be the sum of a process and the process boundary of another process.
editor note: Simons uses different terminology for relations of occurrents to regions: Denote the spatio-temporal location of a given occurrent e by 'spn[e]' and call this region its span. We may say an occurrent is at its span, in any larger region, and covers any smaller region. Now suppose we have fixed a frame of reference so that we can speak not merely of spatio-temporal but also of spatial regions (places) and temporal regions (times). The spread of an occurrent, (relative to a frame of reference) is the space it exactly occupies, and its spell is likewise the time it exactly occupies. We write 'spr[e]' and `spl[e]' respectively for the spread and spell of e, omitting mention of the frame.
IAO_0000412: agro.owl
IAO_0000412: ecocore.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000600: An occurrent is an entity that unfolds itself in time or it is the instantaneous boundary of such an entity (for example a beginning or an ending) or it is a temporal or spatiotemporal region which such an entity occupies_temporal_region or occupies_spatiotemporal_region. (axiom label in BFO2 Reference: [077-002])
IAO_0000601: Every occurrent occupies_spatiotemporal_region some spatiotemporal region. (axiom label in BFO2 Reference: [108-001])
IAO_0000601: b is an occurrent entity iff b is an entity that has temporal parts. (axiom label in BFO2 Reference: [079-001])
IAO_0000602: (forall (x) (if (Occurrent x) (exists (r) (and (SpatioTemporalRegion r) (occupiesSpatioTemporalRegion x r))))) // axiom label in BFO2 CLIF: [108-001]
IAO_0000602: (forall (x) (iff (Occurrent x) (and (Entity x) (exists (y) (temporalPartOf y x))))) // axiom label in BFO2 CLIF: [079-001]

Axiom
annotated source: occurrent
annotated property: editor note
annotated target: Occurrent doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. An example would be the sum of a process and the process boundary of another process.
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000006
comment: per discussion with Barry Smith

Axiom
annotated source: occurrent
annotated property: editor note
annotated target: Simons uses different terminology for relations of occurrents to regions: Denote the spatio-temporal location of a given occurrent e by 'spn[e]' and call this region its span. We may say an occurrent is at its span, in any larger region, and covers any smaller region. Now suppose we have fixed a frame of reference so that we can speak not merely of spatio-temporal but also of spatial regions (places) and temporal regions (times). The spread of an occurrent, (relative to a frame of reference) is the space it exactly occupies, and its spell is likewise the time it exactly occupies. We write 'spr[e]' and `spl[e]' respectively for the spread and spell of e, omitting mention of the frame.
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000012

Axiom
annotated source: occurrent
annotated property: IAO_0000600
annotated target: An occurrent is an entity that unfolds itself in time or it is the instantaneous boundary of such an entity (for example a beginning or an ending) or it is a temporal or spatiotemporal region which such an entity occupies_temporal_region or occupies_spatiotemporal_region. (axiom label in BFO2 Reference: [077-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/077-002

Axiom
annotated source: occurrent
annotated property: IAO_0000601
annotated target: Every occurrent occupies_spatiotemporal_region some spatiotemporal region. (axiom label in BFO2 Reference: [108-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/108-001

Axiom
annotated source: occurrent
annotated property: IAO_0000601
annotated target: b is an occurrent entity iff b is an entity that has temporal parts. (axiom label in BFO2 Reference: [079-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/079-001

Axiom
annotated source: occurrent
annotated property: IAO_0000602
annotated target: (forall (x) (if (Occurrent x) (exists (r) (and (SpatioTemporalRegion r) (occupiesSpatioTemporalRegion x r))))) // axiom label in BFO2 CLIF: [108-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/108-001

Axiom
annotated source: occurrent
annotated property: IAO_0000602
annotated target: (forall (x) (iff (Occurrent x) (and (Entity x) (exists (y) (temporalPartOf y x))))) // axiom label in BFO2 CLIF: [079-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/079-001

independent continuant
type: Class
subclass of: continuant
subclass of: Restriction
  on property: part of
  all values from: independent continuant
BFO_0000179: ic
BFO_0000180: IndependentContinuant
IAO_0000112: a chair
IAO_0000112: a heart
IAO_0000112: a leg
IAO_0000112: a molecule
IAO_0000112: a spatial region
IAO_0000112: an atom
IAO_0000112: an orchestra.
IAO_0000112: an organism
IAO_0000112: the bottom right portion of a human torso
IAO_0000112: the interior of your mouth
definition: A continuant that is a bearer of quality and realizable entity entities, in which other entities inhere and which itself cannot inhere in anything.
definition: b is an independent continuant = Def. b is a continuant which is such that there is no c and no t such that b s-depends_on c at t. (axiom label in BFO2 Reference: [017-002])
IAO_0000412: agro.owl
IAO_0000412: dron.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000601: For any independent continuant b and any time t there is some spatial region r such that b is located_in r at t. (axiom label in BFO2 Reference: [134-001])
IAO_0000601: For every independent continuant b and time t during the region of time spanned by its life, there are entities which s-depends_on b during t. (axiom label in BFO2 Reference: [018-002])
IAO_0000602: (forall (x t) (if (IndependentContinuant x) (exists (r) (and (SpatialRegion r) (locatedInAt x r t))))) // axiom label in BFO2 CLIF: [134-001]
IAO_0000602: (forall (x t) (if (and (IndependentContinuant x) (existsAt x t)) (exists (y) (and (Entity y) (specificallyDependsOnAt y x t))))) // axiom label in BFO2 CLIF: [018-002]
IAO_0000602: (iff (IndependentContinuant a) (and (Continuant a) (not (exists (b t) (specificallyDependsOnAt a b t))))) // axiom label in BFO2 CLIF: [017-002]

Axiom
annotated source: independent continuant
annotated property: definition
annotated target: b is an independent continuant = Def. b is a continuant which is such that there is no c and no t such that b s-depends_on c at t. (axiom label in BFO2 Reference: [017-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/017-002

Axiom
annotated source: independent continuant
annotated property: IAO_0000601
annotated target: For any independent continuant b and any time t there is some spatial region r such that b is located_in r at t. (axiom label in BFO2 Reference: [134-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/134-001

Axiom
annotated source: independent continuant
annotated property: IAO_0000601
annotated target: For every independent continuant b and time t during the region of time spanned by its life, there are entities which s-depends_on b during t. (axiom label in BFO2 Reference: [018-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/018-002

Axiom
annotated source: independent continuant
annotated property: IAO_0000602
annotated target: (forall (x t) (if (IndependentContinuant x) (exists (r) (and (SpatialRegion r) (locatedInAt x r t))))) // axiom label in BFO2 CLIF: [134-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/134-001

Axiom
annotated source: independent continuant
annotated property: IAO_0000602
annotated target: (forall (x t) (if (and (IndependentContinuant x) (existsAt x t)) (exists (y) (and (Entity y) (specificallyDependsOnAt y x t))))) // axiom label in BFO2 CLIF: [018-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/018-002

Axiom
annotated source: independent continuant
annotated property: IAO_0000602
annotated target: (iff (IndependentContinuant a) (and (Continuant a) (not (exists (b t) (specificallyDependsOnAt a b t))))) // axiom label in BFO2 CLIF: [017-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/017-002

spatial region
type: Class
subclass of: immaterial entity

temporal region
type: Class
subclass of: occurrent
BFO_0000179: t-region
BFO_0000180: TemporalRegion
editor note: Temporal region doesn't have a closure axiom because the subclasses don't exhaust all possibilites. An example would be the mereological sum of a temporal instant and a temporal interval that doesn't overlap the instant. In this case the resultant temporal region is neither 0-dimensional nor 1-dimensional
IAO_0000600: A temporal region is an occurrent entity that is part of time as defined relative to some reference frame. (axiom label in BFO2 Reference: [100-001])
IAO_0000601: All parts of temporal regions are temporal regions. (axiom label in BFO2 Reference: [101-001])
IAO_0000601: Every temporal region t is such that t occupies_temporal_region t. (axiom label in BFO2 Reference: [119-002])
IAO_0000602: (forall (r) (if (TemporalRegion r) (occupiesTemporalRegion r r))) // axiom label in BFO2 CLIF: [119-002]
IAO_0000602: (forall (x y) (if (and (TemporalRegion x) (occurrentPartOf y x)) (TemporalRegion y))) // axiom label in BFO2 CLIF: [101-001]
IAO_0000602: (forall (x) (if (TemporalRegion x) (Occurrent x))) // axiom label in BFO2 CLIF: [100-001]

Axiom
annotated source: temporal region
annotated property: editor note
annotated target: Temporal region doesn't have a closure axiom because the subclasses don't exhaust all possibilites. An example would be the mereological sum of a temporal instant and a temporal interval that doesn't overlap the instant. In this case the resultant temporal region is neither 0-dimensional nor 1-dimensional
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000003
comment: per discussion with Barry Smith

Axiom
annotated source: temporal region
annotated property: IAO_0000600
annotated target: A temporal region is an occurrent entity that is part of time as defined relative to some reference frame. (axiom label in BFO2 Reference: [100-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/100-001

Axiom
annotated source: temporal region
annotated property: IAO_0000601
annotated target: All parts of temporal regions are temporal regions. (axiom label in BFO2 Reference: [101-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/101-001

Axiom
annotated source: temporal region
annotated property: IAO_0000601
annotated target: Every temporal region t is such that t occupies_temporal_region t. (axiom label in BFO2 Reference: [119-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/119-002

Axiom
annotated source: temporal region
annotated property: IAO_0000602
annotated target: (forall (r) (if (TemporalRegion r) (occupiesTemporalRegion r r))) // axiom label in BFO2 CLIF: [119-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/119-002

Axiom
annotated source: temporal region
annotated property: IAO_0000602
annotated target: (forall (x y) (if (and (TemporalRegion x) (occurrentPartOf y x)) (TemporalRegion y))) // axiom label in BFO2 CLIF: [101-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/101-001

Axiom
annotated source: temporal region
annotated property: IAO_0000602
annotated target: (forall (x) (if (TemporalRegion x) (Occurrent x))) // axiom label in BFO2 CLIF: [100-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/100-001

process
type: Class
subclass of: occurrent
BFO_0000179: process
BFO_0000180: Process
IAO_0000112: a process of cell-division, \ a beating of the heart
IAO_0000112: a process of meiosis
IAO_0000112: a process of sleeping
IAO_0000112: the course of a disease
IAO_0000112: the flight of a bird
IAO_0000112: the life of an organism
IAO_0000112: your process of aging.
definition: An occurrent that has temporal proper parts and for some time t, p s-depends_on some material entity at t.
definition: p is a process = Def. p is an occurrent that has temporal proper parts and for some time t, p s-depends_on some material entity at t. (axiom label in BFO2 Reference: [083-003])
editor note: BFO 2 Reference: The realm of occurrents is less pervasively marked by the presence of natural units than is the case in the realm of independent continuants. Thus there is here no counterpart of ‘object’. In BFO 1.0 ‘process’ served as such a counterpart. In BFO 2.0 ‘process’ is, rather, the occurrent counterpart of ‘material entity’. Those natural – as contrasted with engineered, which here means: deliberately executed – units which do exist in the realm of occurrents are typically either parasitic on the existence of natural units on the continuant side, or they are fiat in nature. Thus we can count lives; we can count football games; we can count chemical reactions performed in experiments or in chemical manufacturing. We cannot count the processes taking place, for instance, in an episode of insect mating behavior.Even where natural units are identifiable, for example cycles in a cyclical process such as the beating of a heart or an organism’s sleep/wake cycle, the processes in question form a sequence with no discontinuities (temporal gaps) of the sort that we find for instance where billiard balls or zebrafish or planets are separated by clear spatial gaps. Lives of organisms are process units, but they too unfold in a continuous series from other, prior processes such as fertilization, and they unfold in turn in continuous series of post-life processes such as post-mortem decay. Clear examples of boundaries of processes are almost always of the fiat sort (midnight, a time of death as declared in an operating theater or on a death certificate, the initiation of a state of war)
IAO_0000412: agro.owl
IAO_0000412: cob.owl
IAO_0000412: ecocore.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000602: (iff (Process a) (and (Occurrent a) (exists (b) (properTemporalPartOf b a)) (exists (c t) (and (MaterialEntity c) (specificallyDependsOnAt a c t))))) // axiom label in BFO2 CLIF: [083-003]
has OBO namespace: source
id: BFO:0000015

Axiom
annotated source: process
annotated property: definition
annotated target: p is a process = Def. p is an occurrent that has temporal proper parts and for some time t, p s-depends_on some material entity at t. (axiom label in BFO2 Reference: [083-003])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/083-003

Axiom
annotated source: process
annotated property: IAO_0000602
annotated target: (iff (Process a) (and (Occurrent a) (exists (b) (properTemporalPartOf b a)) (exists (c t) (and (MaterialEntity c) (specificallyDependsOnAt a c t))))) // axiom label in BFO2 CLIF: [083-003]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/083-003

disposition
type: Class
subclass of: realizable entity
BFO_0000179: disposition
BFO_0000180: Disposition
IAO_0000112: an atom of element X has the disposition to decay to an atom of element Y
IAO_0000112: certain people have a predisposition to colon cancer
IAO_0000112: children are innately disposed to categorize objects in certain ways.
IAO_0000112: the cell wall is disposed to filter chemicals in endocytosis and exocytosis
editor note: BFO 2 Reference: Dispositions exist along a strength continuum. Weaker forms of disposition are realized in only a fraction of triggering cases. These forms occur in a significant number of cases of a similar type.
IAO_0000600: b is a disposition means: b is a realizable entity & b’s bearer is some material entity & b is such that if it ceases to exist, then its bearer is physically changed, & b’s realization occurs when and because this bearer is in some special physical circumstances, & this realization occurs in virtue of the bearer’s physical make-up. (axiom label in BFO2 Reference: [062-002])
IAO_0000601: If b is a realizable entity then for all t at which b exists, b s-depends_on some material entity at t. (axiom label in BFO2 Reference: [063-002])
IAO_0000602: (forall (x t) (if (and (RealizableEntity x) (existsAt x t)) (exists (y) (and (MaterialEntity y) (specificallyDepends x y t))))) // axiom label in BFO2 CLIF: [063-002]
IAO_0000602: (forall (x) (if (Disposition x) (and (RealizableEntity x) (exists (y) (and (MaterialEntity y) (bearerOfAt x y t)))))) // axiom label in BFO2 CLIF: [062-002]

Axiom
annotated source: disposition
annotated property: IAO_0000600
annotated target: b is a disposition means: b is a realizable entity & b’s bearer is some material entity & b is such that if it ceases to exist, then its bearer is physically changed, & b’s realization occurs when and because this bearer is in some special physical circumstances, & this realization occurs in virtue of the bearer’s physical make-up. (axiom label in BFO2 Reference: [062-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/062-002

Axiom
annotated source: disposition
annotated property: IAO_0000601
annotated target: If b is a realizable entity then for all t at which b exists, b s-depends_on some material entity at t. (axiom label in BFO2 Reference: [063-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/063-002

Axiom
annotated source: disposition
annotated property: IAO_0000602
annotated target: (forall (x t) (if (and (RealizableEntity x) (existsAt x t)) (exists (y) (and (MaterialEntity y) (specificallyDepends x y t))))) // axiom label in BFO2 CLIF: [063-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/063-002

Axiom
annotated source: disposition
annotated property: IAO_0000602
annotated target: (forall (x) (if (Disposition x) (and (RealizableEntity x) (exists (y) (and (MaterialEntity y) (bearerOfAt x y t)))))) // axiom label in BFO2 CLIF: [062-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/062-002

realizable entity
type: Class
subclass of: specifically dependent continuant
subclass of: Restriction
  on property: part of
  all values from: realizable entity
BFO_0000179: realizable
BFO_0000180: RealizableEntity
IAO_0000112: the disposition of this piece of metal to conduct electricity.
IAO_0000112: the disposition of your blood to coagulate
IAO_0000112: the function of your reproductive organs
IAO_0000112: the role of being a doctor
IAO_0000112: the role of this boundary to delineate where Utah and Colorado meet
definition: A specifically dependent continuant that inheres in continuant entities and are not exhibited in full at every time in which it inheres in an entity or group of entities. The exhibition or actualization of a realizable entity is a particular manifestation, functioning or process that occurs under certain circumstances.
IAO_0000600: To say that b is a realizable entity is to say that b is a specifically dependent continuant that inheres in some independent continuant which is not a spatial region and is of a type instances of which are realized in processes of a correlated type. (axiom label in BFO2 Reference: [058-002])
IAO_0000601: All realizable dependent continuants have independent continuants that are not spatial regions as their bearers. (axiom label in BFO2 Reference: [060-002])
IAO_0000602: (forall (x t) (if (RealizableEntity x) (exists (y) (and (IndependentContinuant y) (not (SpatialRegion y)) (bearerOfAt y x t))))) // axiom label in BFO2 CLIF: [060-002]
IAO_0000602: (forall (x) (if (RealizableEntity x) (and (SpecificallyDependentContinuant x) (exists (y) (and (IndependentContinuant y) (not (SpatialRegion y)) (inheresIn x y)))))) // axiom label in BFO2 CLIF: [058-002]

Axiom
annotated source: realizable entity
annotated property: IAO_0000600
annotated target: To say that b is a realizable entity is to say that b is a specifically dependent continuant that inheres in some independent continuant which is not a spatial region and is of a type instances of which are realized in processes of a correlated type. (axiom label in BFO2 Reference: [058-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/058-002

Axiom
annotated source: realizable entity
annotated property: IAO_0000601
annotated target: All realizable dependent continuants have independent continuants that are not spatial regions as their bearers. (axiom label in BFO2 Reference: [060-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/060-002

Axiom
annotated source: realizable entity
annotated property: IAO_0000602
annotated target: (forall (x t) (if (RealizableEntity x) (exists (y) (and (IndependentContinuant y) (not (SpatialRegion y)) (bearerOfAt y x t))))) // axiom label in BFO2 CLIF: [060-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/060-002

Axiom
annotated source: realizable entity
annotated property: IAO_0000602
annotated target: (forall (x) (if (RealizableEntity x) (and (SpecificallyDependentContinuant x) (exists (y) (and (IndependentContinuant y) (not (SpatialRegion y)) (inheresIn x y)))))) // axiom label in BFO2 CLIF: [058-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/058-002

quality
type: Class
subclass of: specifically dependent continuant
subclass of: Restriction
  on property: part of
  all values from: quality
BFO_0000179: quality
BFO_0000180: Quality
IAO_0000112: the ambient temperature of this portion of air
IAO_0000112: the color of a tomato
IAO_0000112: the length of the circumference of your waist
IAO_0000112: the mass of this piece of gold.
IAO_0000112: the shape of your nose
IAO_0000112: the shape of your nostril
IAO_0000600: a quality is a specifically dependent continuant that, in contrast to roles and dispositions, does not require any further process in order to be realized. (axiom label in BFO2 Reference: [055-001])
IAO_0000601: If an entity is a quality at any time that it exists, then it is a quality at every time that it exists. (axiom label in BFO2 Reference: [105-001])
IAO_0000602: (forall (x) (if (Quality x) (SpecificallyDependentContinuant x))) // axiom label in BFO2 CLIF: [055-001]
IAO_0000602: (forall (x) (if (exists (t) (and (existsAt x t) (Quality x))) (forall (t_1) (if (existsAt x t_1) (Quality x))))) // axiom label in BFO2 CLIF: [105-001]

Axiom
annotated source: quality
annotated property: IAO_0000600
annotated target: a quality is a specifically dependent continuant that, in contrast to roles and dispositions, does not require any further process in order to be realized. (axiom label in BFO2 Reference: [055-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/055-001

Axiom
annotated source: quality
annotated property: IAO_0000601
annotated target: If an entity is a quality at any time that it exists, then it is a quality at every time that it exists. (axiom label in BFO2 Reference: [105-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/105-001

Axiom
annotated source: quality
annotated property: IAO_0000602
annotated target: (forall (x) (if (Quality x) (SpecificallyDependentContinuant x))) // axiom label in BFO2 CLIF: [055-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/055-001

Axiom
annotated source: quality
annotated property: IAO_0000602
annotated target: (forall (x) (if (exists (t) (and (existsAt x t) (Quality x))) (forall (t_1) (if (existsAt x t_1) (Quality x))))) // axiom label in BFO2 CLIF: [105-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/105-001

specifically dependent continuant
type: Class
subclass of: continuant
subclass of: Restriction
  on property: part of
  all values from: specifically dependent continuant
BFO_0000179: sdc
BFO_0000180: SpecificallyDependentContinuant
IAO_0000112: Reciprocal specifically dependent continuants: the function of this key to open this lock and the mutually dependent disposition of this lock: to be opened by this key
IAO_0000112: of one-sided specifically dependent continuants: the mass of this tomato
IAO_0000112: of relational dependent continuants (multiple bearers): John’s love for Mary, the ownership relation between John and this statue, the relation of authority between John and his subordinates.
IAO_0000112: the disposition of this fish to decay
IAO_0000112: the function of this heart: to pump blood
IAO_0000112: the mutual dependence of proton donors and acceptors in chemical reactions [79
IAO_0000112: the mutual dependence of the role predator and the role prey as played by two organisms in a given interaction
IAO_0000112: the pink color of a medium rare piece of grilled filet mignon at its center
IAO_0000112: the role of being a doctor
IAO_0000112: the shape of this hole.
IAO_0000112: the smell of this portion of mozzarella
definition: A continuant that inheres in or is borne by other entities. Every instance of A requires some specific instance of B which must always be the same.
definition: b is a relational specifically dependent continuant = Def. b is a specifically dependent continuant and there are n > 1 independent continuants c1, … cn which are not spatial regions are such that for all 1 i < j n, ci and cj share no common parts, are such that for each 1 i n, b s-depends_on ci at every time t during the course of b’s existence (axiom label in BFO2 Reference: [131-004])
definition: b is a specifically dependent continuant = Def. b is a continuant & there is some independent continuant c which is not a spatial region and which is such that b s-depends_on c at every time t during the course of b’s existence. (axiom label in BFO2 Reference: [050-003])
editor note: Specifically dependent continuant doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. We're not sure what else will develop here, but for example there are questions such as what are promises, obligation, etc.
IAO_0000602: (iff (SpecificallyDependentContinuant a) (and (Continuant a) (forall (t) (if (existsAt a t) (exists (b) (and (IndependentContinuant b) (not (SpatialRegion b)) (specificallyDependsOnAt a b t))))))) // axiom label in BFO2 CLIF: [050-003]

Axiom
annotated source: specifically dependent continuant
annotated property: definition
annotated target: b is a specifically dependent continuant = Def. b is a continuant & there is some independent continuant c which is not a spatial region and which is such that b s-depends_on c at every time t during the course of b’s existence. (axiom label in BFO2 Reference: [050-003])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/050-003

Axiom
annotated source: specifically dependent continuant
annotated property: editor note
annotated target: Specifically dependent continuant doesn't have a closure axiom because the subclasses don't necessarily exhaust all possibilites. We're not sure what else will develop here, but for example there are questions such as what are promises, obligation, etc.
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/0000005
comment: per discussion with Barry Smith

Axiom
annotated source: specifically dependent continuant
annotated property: IAO_0000602
annotated target: (iff (SpecificallyDependentContinuant a) (and (Continuant a) (forall (t) (if (existsAt a t) (exists (b) (and (IndependentContinuant b) (not (SpatialRegion b)) (specificallyDependsOnAt a b t))))))) // axiom label in BFO2 CLIF: [050-003]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/050-003

role
type: Class
equivalent class: CHEBI_50906
subclass of: CHEBI_50906
BFO_0000179: role
BFO_0000180: Role
IAO_0000112: John’s role of husband to Mary is dependent on Mary’s role of wife to John, and both are dependent on the object aggregate comprising John and Mary as member parts joined together through the relational quality of being married.
IAO_0000112: the priest role
IAO_0000112: the role of a boundary to demarcate two neighboring administrative territories
IAO_0000112: the role of a building in serving as a military target
IAO_0000112: the role of a stone in marking a property boundary
IAO_0000112: the role of subject in a clinical trial
IAO_0000112: the student role
definition: A realizable entity the manifestation of which brings about some result or end that is not essential to a continuant in virtue of the kind of thing that it is but that can be served or participated in by that kind of continuant in some kinds of natural, social or institutional contexts.
editor note: BFO 2 Reference: One major family of examples of non-rigid universals involves roles, and ontologies developed for corresponding administrative purposes may consist entirely of representatives of entities of this sort. Thus ‘professor’, defined as follows,b instance_of professor at t =Def. there is some c, c instance_of professor role & c inheres_in b at t.denotes a non-rigid universal and so also do ‘nurse’, ‘student’, ‘colonel’, ‘taxpayer’, and so forth. (These terms are all, in the jargon of philosophy, phase sortals.) By using role terms in definitions, we can create a BFO conformant treatment of such entities drawing on the fact that, while an instance of professor may be simultaneously an instance of trade union member, no instance of the type professor role is also (at any time) an instance of the type trade union member role (any more than any instance of the type color is at any time an instance of the type length).If an ontology of employment positions should be defined in terms of roles following the above pattern, this enables the ontology to do justice to the fact that individuals instantiate the corresponding universals – professor, sergeant, nurse – only during certain phases in their lives.
IAO_0000600: b is a role means: b is a realizable entity & b exists because there is some single bearer that is in some special physical, social, or institutional set of circumstances in which this bearer does not have to be& b is not such that, if it ceases to exist, then the physical make-up of the bearer is thereby changed. (axiom label in BFO2 Reference: [061-001])
IAO_0000602: (forall (x) (if (Role x) (RealizableEntity x))) // axiom label in BFO2 CLIF: [061-001]

Axiom
annotated source: role
annotated property: IAO_0000600
annotated target: b is a role means: b is a realizable entity & b exists because there is some single bearer that is in some special physical, social, or institutional set of circumstances in which this bearer does not have to be& b is not such that, if it ceases to exist, then the physical make-up of the bearer is thereby changed. (axiom label in BFO2 Reference: [061-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/061-001

Axiom
annotated source: role
annotated property: IAO_0000602
annotated target: (forall (x) (if (Role x) (RealizableEntity x))) // axiom label in BFO2 CLIF: [061-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/061-001

fiat object
type: Class
subclass of: material entity
BFO_0000179: fiat-object-part
BFO_0000180: FiatObjectPart
IAO_0000112: or with divisions drawn by cognitive subjects for practical reasons, such as the division of a cake (before slicing) into (what will become) slices (and thus member parts of an object aggregate). However, this does not mean that fiat object parts are dependent for their existence on divisions or delineations effected by cognitive subjects. If, for example, it is correct to conceive geological layers of the Earth as fiat object parts of the Earth, then even though these layers were first delineated in recent times, still existed long before such delineation and what holds of these layers (for example that the oldest layers are also the lowest layers) did not begin to hold because of our acts of delineation.Treatment of material entity in BFOExamples viewed by some as problematic cases for the trichotomy of fiat object part, object, and object aggregate include: a mussel on (and attached to) a rock, a slime mold, a pizza, a cloud, a galaxy, a railway train with engine and multiple carriages, a clonal stand of quaking aspen, a bacterial community (biofilm), a broken femur. Note that, as Aristotle already clearly recognized, such problematic cases – which lie at or near the penumbra of instances defined by the categories in question – need not invalidate these categories. The existence of grey objects does not prove that there are not objects which are black and objects which are white; the existence of mules does not prove that there are not objects which are donkeys and objects which are horses. It does, however, show that the examples in question need to be addressed carefully in order to show how they can be fitted into the proposed scheme, for example by recognizing additional subdivisions [29
IAO_0000112: the FMA:regional parts of an intact human body.
IAO_0000112: the Western hemisphere of the Earth
IAO_0000112: the division of the brain into regions
IAO_0000112: the division of the planet into hemispheres
IAO_0000112: the dorsal and ventral surfaces of the body
IAO_0000112: the upper and lower lobes of the left lung
editor note: BFO 2 Reference: Most examples of fiat object parts are associated with theoretically drawn divisions
IAO_0000412: envo.owl
IAO_0000600: b is a fiat object part = Def. b is a material entity which is such that for all times t, if b exists at t then there is some object c such that b proper continuant_part of c at t and c is demarcated from the remainder of c by a two-dimensional continuant fiat boundary. (axiom label in BFO2 Reference: [027-004])
IAO_0000602: (forall (x) (if (FiatObjectPart x) (and (MaterialEntity x) (forall (t) (if (existsAt x t) (exists (y) (and (Object y) (properContinuantPartOfAt x y t)))))))) // axiom label in BFO2 CLIF: [027-004]
label: fiat object part

Axiom
annotated source: fiat object
annotated property: IAO_0000600
annotated target: b is a fiat object part = Def. b is a material entity which is such that for all times t, if b exists at t then there is some object c such that b proper continuant_part of c at t and c is demarcated from the remainder of c by a two-dimensional continuant fiat boundary. (axiom label in BFO2 Reference: [027-004])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/027-004

Axiom
annotated source: fiat object
annotated property: IAO_0000602
annotated target: (forall (x) (if (FiatObjectPart x) (and (MaterialEntity x) (forall (t) (if (existsAt x t) (exists (y) (and (Object y) (properContinuantPartOfAt x y t)))))))) // axiom label in BFO2 CLIF: [027-004]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/027-004

object aggregate
type: Class
subclass of: material entity

site
type: Class
subclass of: immaterial entity

object
type: Class
subclass of: material entity

generically dependent continuant
type: Class
subclass of: continuant
subclass of: Restriction
  on property: part of
  all values from: generically dependent continuant
BFO_0000179: gdc
BFO_0000180: GenericallyDependentContinuant
IAO_0000112: The entries in your database are patterns instantiated as quality instances in your hard drive. The database itself is an aggregate of such patterns. When you create the database you create a particular instance of the generically dependent continuant type database. Each entry in the database is an instance of the generically dependent continuant type IAO: information content entity.
IAO_0000112: the pdf file on your laptop, the pdf file that is a copy thereof on my laptop
IAO_0000112: the sequence of this protein molecule; the sequence that is a copy thereof in that protein molecule.
definition: A continuant that is dependent on one or other independent continuant bearers. For every instance of A requires some instance of (an independent continuant type) B but which instance of B serves can change from time to time.
definition: b is a generically dependent continuant = Def. b is a continuant that g-depends_on one or more other entities. (axiom label in BFO2 Reference: [074-001])
IAO_0000412: obi.owl
IAO_0000602: (iff (GenericallyDependentContinuant a) (and (Continuant a) (exists (b t) (genericallyDependsOnAt a b t)))) // axiom label in BFO2 CLIF: [074-001]

Axiom
annotated source: generically dependent continuant
annotated property: definition
annotated target: b is a generically dependent continuant = Def. b is a continuant that g-depends_on one or more other entities. (axiom label in BFO2 Reference: [074-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/074-001

Axiom
annotated source: generically dependent continuant
annotated property: IAO_0000602
annotated target: (iff (GenericallyDependentContinuant a) (and (Continuant a) (exists (b t) (genericallyDependsOnAt a b t)))) // axiom label in BFO2 CLIF: [074-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/074-001

function
type: Class
subclass of: disposition
BFO_0000179: function
BFO_0000180: Function
IAO_0000112: the function of a hammer to drive in nails
IAO_0000112: the function of a heart pacemaker to regulate the beating of a heart through electricity
IAO_0000112: the function of amylase in saliva to break down starch into sugar
editor note: BFO 2 Reference: In the past, we have distinguished two varieties of function, artifactual function and biological function. These are not asserted subtypes of BFO:function however, since the same function – for example: to pump, to transport – can exist both in artifacts and in biological entities. The asserted subtypes of function that would be needed in order to yield a separate monoheirarchy are not artifactual function, biological function, etc., but rather transporting function, pumping function, etc.
IAO_0000600: A function is a disposition that exists in virtue of the bearer’s physical make-up and this physical make-up is something the bearer possesses because it came into being, either through evolution (in the case of natural biological entities) or through intentional design (in the case of artifacts), in order to realize processes of a certain sort. (axiom label in BFO2 Reference: [064-001])
IAO_0000602: (forall (x) (if (Function x) (Disposition x))) // axiom label in BFO2 CLIF: [064-001]

Axiom
annotated source: function
annotated property: IAO_0000600
annotated target: A function is a disposition that exists in virtue of the bearer’s physical make-up and this physical make-up is something the bearer possesses because it came into being, either through evolution (in the case of natural biological entities) or through intentional design (in the case of artifacts), in order to realize processes of a certain sort. (axiom label in BFO2 Reference: [064-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/064-001

Axiom
annotated source: function
annotated property: IAO_0000602
annotated target: (forall (x) (if (Function x) (Disposition x))) // axiom label in BFO2 CLIF: [064-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/064-001

one-dimensional temporal region
type: Class
subclass of: temporal region
BFO_0000179: 1d-t-region
BFO_0000180: OneDimensionalTemporalRegion
IAO_0000112: the temporal region during which a process occurs.
editor note: BFO 2 Reference: A temporal interval is a special kind of one-dimensional temporal region, namely one that is self-connected (is without gaps or breaks).
IAO_0000600: A one-dimensional temporal region is a temporal region that is extended. (axiom label in BFO2 Reference: [103-001])
IAO_0000602: (forall (x) (if (OneDimensionalTemporalRegion x) (TemporalRegion x))) // axiom label in BFO2 CLIF: [103-001]

Axiom
annotated source: one-dimensional temporal region
annotated property: IAO_0000600
annotated target: A one-dimensional temporal region is a temporal region that is extended. (axiom label in BFO2 Reference: [103-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/103-001

Axiom
annotated source: one-dimensional temporal region
annotated property: IAO_0000602
annotated target: (forall (x) (if (OneDimensionalTemporalRegion x) (TemporalRegion x))) // axiom label in BFO2 CLIF: [103-001]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/103-001

material entity
type: Class
subclass of: independent continuant
BFO_0000179: material
BFO_0000180: MaterialEntity
IAO_0000111: material entity
IAO_0000112: a flame
IAO_0000112: a forest fire
IAO_0000112: a human being
IAO_0000112: a hurricane
IAO_0000112: a photon
IAO_0000112: a puff of smoke
IAO_0000112: a sea wave
IAO_0000112: a tornado
IAO_0000112: an aggregate of human beings.
IAO_0000112: an energy wave
IAO_0000112: an epidemic
IAO_0000112: the undetached arm of a human being
definition: An independent continuant that is spatially extended whose identity is independent of that of other entities and can be maintained through time.
editor note: BFO 2 Reference: Material entities (continuants) can preserve their identity even while gaining and losing material parts. Continuants are contrasted with occurrents, which unfold themselves in successive temporal parts or phases [60
editor note: BFO 2 Reference: Object, Fiat Object Part and Object Aggregate are not intended to be exhaustive of Material Entity. Users are invited to propose new subcategories of Material Entity.
editor note: BFO 2 Reference: ‘Matter’ is intended to encompass both mass and energy (we will address the ontological treatment of portions of energy in a later version of BFO). A portion of matter is anything that includes elementary particles among its proper or improper parts: quarks and leptons, including electrons, as the smallest particles thus far discovered; baryons (including protons and neutrons) at a higher level of granularity; atoms and molecules at still higher levels, forming the cells, organs, organisms and other material entities studied by biologists, the portions of rock studied by geologists, the fossils studied by paleontologists, and so on.Material entities are three-dimensional entities (entities extended in three spatial dimensions), as contrasted with the processes in which they participate, which are four-dimensional entities (entities extended also along the dimension of time).According to the FMA, material entities may have immaterial entities as parts – including the entities identified below as sites; for example the interior (or ‘lumen’) of your small intestine is a part of your body. BFO 2.0 embodies a decision to follow the FMA here.
IAO_0000412: cdno.owl
IAO_0000412: dron.owl
IAO_0000412: envo.owl
IAO_0000412: obi.owl
IAO_0000600: A material entity is an independent continuant that has some portion of matter as proper or improper continuant part. (axiom label in BFO2 Reference: [019-002])
IAO_0000601: Every entity which has a material entity as continuant part is a material entity. (axiom label in BFO2 Reference: [020-002])
IAO_0000601: every entity of which a material entity is continuant part is also a material entity. (axiom label in BFO2 Reference: [021-002])
IAO_0000602: (forall (x) (if (MaterialEntity x) (IndependentContinuant x))) // axiom label in BFO2 CLIF: [019-002]
IAO_0000602: (forall (x) (if (and (Entity x) (exists (y t) (and (MaterialEntity y) (continuantPartOfAt x y t)))) (MaterialEntity x))) // axiom label in BFO2 CLIF: [021-002]
IAO_0000602: (forall (x) (if (and (Entity x) (exists (y t) (and (MaterialEntity y) (continuantPartOfAt y x t)))) (MaterialEntity x))) // axiom label in BFO2 CLIF: [020-002]
has OBO namespace: bfo
id: BFO:0000040

Axiom
annotated source: material entity
annotated property: IAO_0000600
annotated target: A material entity is an independent continuant that has some portion of matter as proper or improper continuant part. (axiom label in BFO2 Reference: [019-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/019-002

Axiom
annotated source: material entity
annotated property: IAO_0000601
annotated target: Every entity which has a material entity as continuant part is a material entity. (axiom label in BFO2 Reference: [020-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/020-002

Axiom
annotated source: material entity
annotated property: IAO_0000601
annotated target: every entity of which a material entity is continuant part is also a material entity. (axiom label in BFO2 Reference: [021-002])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/021-002

Axiom
annotated source: material entity
annotated property: IAO_0000602
annotated target: (forall (x) (if (MaterialEntity x) (IndependentContinuant x))) // axiom label in BFO2 CLIF: [019-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/019-002

Axiom
annotated source: material entity
annotated property: IAO_0000602
annotated target: (forall (x) (if (and (Entity x) (exists (y t) (and (MaterialEntity y) (continuantPartOfAt x y t)))) (MaterialEntity x))) // axiom label in BFO2 CLIF: [021-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/021-002

Axiom
annotated source: material entity
annotated property: IAO_0000602
annotated target: (forall (x) (if (and (Entity x) (exists (y t) (and (MaterialEntity y) (continuantPartOfAt y x t)))) (MaterialEntity x))) // axiom label in BFO2 CLIF: [020-002]
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/020-002

continuant fiat boundary
type: Class
subclass of: immaterial entity
definition: b is a continuant fiat boundary = Def. b is an immaterial entity that is of zero, one or two dimensions and does not include a spatial region as part. (axiom label in BFO2 Reference: [029-001])

Axiom
annotated source: continuant fiat boundary
annotated property: definition
annotated target: b is a continuant fiat boundary = Def. b is an immaterial entity that is of zero, one or two dimensions and does not include a spatial region as part. (axiom label in BFO2 Reference: [029-001])
IAO_0010000: http://purl.obolibrary.org/obo/bfo/axiom/029-001

immaterial entity
type: Class
subclass of: independent continuant

anatomical entity
type: Class
subclass of: biological entity
definition: Biological entity that is either an individual member of a biological species or constitutes the structural organization of an individual member of a biological species.
IAO_0000412: caro.owl
has OBO namespace: spatial
id: CARO:0000000

Axiom
annotated source: anatomical entity
annotated property: definition
annotated target: Biological entity that is either an individual member of a biological species or constitutes the structural organization of an individual member of a biological species.
database_cross_reference: CARO:MAH

anatomical structure
type: Class
subclass of: material anatomical entity
definition: Material anatomical entity that is a single connected structure with inherent 3D shape generated by coordinated expression of the organism's own genome.
IAO_0000412: caro.owl
has OBO namespace: spatial
id: CARO:0000003
label: connected anatomical structure

Axiom
annotated source: anatomical structure
annotated property: definition
annotated target: Material anatomical entity that is a single connected structure with inherent 3D shape generated by coordinated expression of the organism's own genome.
database_cross_reference: CC:DOS

material anatomical entity
type: Class
subclass of: material entity
subclass of: anatomical entity
definition: An anatomical entity that has mass.
IAO_0000412: caro.owl
has OBO namespace: spatial
id: CARO:0000006

Axiom
annotated source: material anatomical entity
annotated property: definition
annotated target: An anatomical entity that has mass.
database_cross_reference: CC:DOS

organism or virus or viroid
type: Class
subclass of: material entity

biological entity
type: Class
subclass of: independent continuant

dietary chemical component
type: Class
subclass of: FOODON_03411041
definition: A material entity that is ingested and contributes to survival, growth and development
IAO_0000412: cdno.owl

available carbohydrate
type: Class
subclass of: CHEBI_16646
definition: Carbohydrates that are absorbed in the small intestine and provide carbohydrate for metabolism in monogastric animals.
IAO_0000412: cdno.owl
has exact synonym: digestible carbohydrate

free sugar
type: Class
subclass of: available carbohydrate
definition: Available carbohydrate in monosaccharide and disaccharide form
IAO_0000412: cdno.owl

dietary fibre
type: Class
subclass of: CHEBI_16646
definition: A carbohydrate that resists enzymatic digestion in the digestive systems of humans and other monogastric species.
IAO_0000412: cdno.owl

soluble dietary fibre
type: Class
subclass of: dietary fibre
definition: Dietary fibre which dissolves in water and is primarily fermented in the colon of monogastric animals by gut bacteria
IAO_0000412: cdno.owl

insoluble dietary fibre
type: Class
subclass of: dietary fibre
definition: Dietary fibre which does not dissolve in water and is inert to digestive enzymes in the upper gastrointestinal tract of monogastric animals.
IAO_0000412: cdno.owl

macro element
type: Class
subclass of: CHEBI_167164
definition: A mineral nutrient that represents a major proportion of the minerals required in the diet
IAO_0000412: cdno.owl
has exact synonym: macromineral

trace element
type: Class
subclass of: CHEBI_167164
definition: Mineral nutrient that is present in a very low concentration within the diet
IAO_0000412: cdno.owl
has exact synonym: micromineral

plant secondary metabolite
type: Class
subclass of: dietary chemical component
definition: A plant metabolite that is not essential for growth or division of plant cells.
IAO_0000412: cdno.owl
has exact synonym: secondary metabolite

vitamin (molecular entity)
type: Class
subclass of: dietary chemical component
definition: An organic molecule that has a vitamin(role)
IAO_0000412: cdno.owl
comment: This term can be assigned to CHEBI or any other ontology that claims it

dietary calcium
type: Class
subclass of: macro element
definition: Calcium ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary chlorine
type: Class
subclass of: macro element
definition: Chlorine ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary magnesium
type: Class
subclass of: macro element
definition: Magnesium ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary phosphorus
type: Class
subclass of: macro element
definition: Phosphorus ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary potassium
type: Class
subclass of: macro element
definition: Potassium ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary sodium
type: Class
subclass of: macro element
definition: Sodium ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary sulfur
type: Class
subclass of: macro element
definition: Sulfur ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary copper
type: Class
subclass of: trace element
definition: Copper ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary fluorine
type: Class
subclass of: trace element
definition: Fluorine ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

dietary iron
type: Class
subclass of: trace element
definition: Iron ingested by an organism that contributes to the survival, growth, development, or other biological function of itself, its bionts, or its holobionts
IAO_0000412: cdno.owl

gum
type: Class
subclass of: CHEBI_18154
definition: A complex carbohydrate with various rheological properties that result in viscoelastic behavior
IAO_0000412: cdno.owl

glucose derived from sucrose
type: Class
equivalent class: Class
  intersection of: CHEBI_17234
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_17992
subclass of: CHEBI_17234
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_17992
definition: Glucose which is derived from sucrose.
IAO_0000412: cdno.owl

fructose derived from sucrose
type: Class
equivalent class: Class
  intersection of: CHEBI_28757
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_17992
subclass of: CHEBI_28757
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_17992
definition: Fructose which is derived from sucrose.
IAO_0000412: cdno.owl

glucose derived from maltose
type: Class
equivalent class: Class
  intersection of: CHEBI_17234
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_17306
subclass of: CHEBI_17234
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_17306
definition: Glucose which is derived from maltose.
IAO_0000412: cdno.owl

raffinose derived from raffinose family oligosaccharide
type: Class
equivalent class: Class
  intersection of: CHEBI_16634
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_74961
subclass of: CHEBI_16634
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_74961
definition: Raffinose which is derived from raffinose family oligosaccharide.
IAO_0000412: cdno.owl

glucose derived from raffinose derived from raffinose family oligosaccharide
type: Class
equivalent class: Class
  intersection of: CHEBI_17234
  intersection of: Restriction
    on property: derives from
    some values from: raffinose derived from raffinose family oligosaccharide
subclass of: CHEBI_17234
subclass of: Restriction
  on property: derives from
  some values from: raffinose derived from raffinose family oligosaccharide
definition: Glucose which is derived from raffinose derived from raffinose family oligosaccharide.
IAO_0000412: cdno.owl

fructose derived from raffinose derived from raffinose family oligosaccharide
type: Class
equivalent class: Class
  intersection of: CHEBI_28757
  intersection of: Restriction
    on property: derives from
    some values from: raffinose derived from raffinose family oligosaccharide
subclass of: CHEBI_28757
subclass of: Restriction
  on property: derives from
  some values from: raffinose derived from raffinose family oligosaccharide
definition: Fructose which is derived from raffinose derived from raffinose family oligosaccharide.
IAO_0000412: cdno.owl

inulin derived from fructan
type: Class
equivalent class: Class
  intersection of: CHEBI_15443
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_28796
subclass of: CHEBI_15443
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_28796
definition: Inulin which is derived from fructan.
IAO_0000412: cdno.owl

fructose derived from inulin derived from fructan
type: Class
equivalent class: Class
  intersection of: CHEBI_28757
  intersection of: Restriction
    on property: derives from
    some values from: inulin derived from fructan
subclass of: CHEBI_28757
subclass of: Restriction
  on property: derives from
  some values from: inulin derived from fructan
definition: Fructose which is derived from inulin derived from fructan.
IAO_0000412: cdno.owl

amino acid derived from protein
type: Class
equivalent class: Class
  intersection of: CHEBI_33709
  intersection of: Restriction
    on property: derives from
    some values from: CHEBI_36080
subclass of: CHEBI_33709
subclass of: Restriction
  on property: derives from
  some values from: CHEBI_36080
definition: Amino acid which is derived from protein.
IAO_0000412: cdno.owl

concentration of dietary chemical component in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary chemical component
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: PATO_0000033
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary chemical component
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary chemical component when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary chemical component concentration

concentration of water in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: water
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: water
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of water when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:WATER
database_cross_reference: USDA_NDB:1051
has exact synonym: material entity water concentration

concentration of carbohydrate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16646
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16646
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of carbohydrate when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: USDA_NDB:1005
database_cross_reference: USDA_NDB:1050
database_cross_reference: USDA_NDB:1072
has exact synonym: material entity carbohydrate concentration

concentration of polysaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18154
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18154
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of polysaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:POLYSAC
has exact synonym: material entity polysaccharide concentration

concentration of inulin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15443
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fructan in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15443
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inulin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:INULN
database_cross_reference: USDA_NDB:1403
has exact synonym: material entity inulin concentration

concentration of monosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35381
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35381
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of monosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:MNSAC
has exact synonym: material entity monosaccharide concentration

concentration of glucose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17234
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of monosaccharide in material entity
subclass of: concentration of free sugar in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17234
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GLUFB
database_cross_reference: INFOODs:GLUS
database_cross_reference: USDA_NDB:1011
has exact synonym: material entity glucose concentration

concentration of fructose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28757
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of free sugar in material entity
subclass of: concentration of ketohexose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28757
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fructose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FRUFB
database_cross_reference: INFOODs:FRUS
database_cross_reference: USDA_NDB:1012
has exact synonym: material entity fructose concentration

concentration of rhamnose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26546
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of monosaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26546
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of rhamnose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:RHAFB
database_cross_reference: INFOODs:RHAS
has exact synonym: material entity rhamnose concentration

concentration of disaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36233
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of oligosaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36233
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of disaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:DISAC
has exact synonym: material entity disaccharide concentration

concentration of sucrose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17992
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of disaccharide in material entity
subclass of: concentration of free sugar in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17992
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sucrose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:SUCS
database_cross_reference: USDA_NDB:1010
has exact synonym: material entity sucrose concentration

concentration of trehalose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27082
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of disaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27082
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of trehalose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:TRES
has exact synonym: material entity trehalose concentration

concentration of maltose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17306
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of disaccharide in material entity
subclass of: concentration of free sugar in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17306
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of maltose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:MALS
database_cross_reference: USDA_NDB:1014
has exact synonym: material entity maltose concentration

concentration of oligosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_50699
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_50699
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of oligosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:OLSAC
database_cross_reference: INFOODs:OLSACM
has exact synonym: material entity oligosaccharide concentration

concentration of raffinose family oligosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_74961
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of oligosaccharide in material entity
subclass of: concentration of soluble dietary fibre in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_74961
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of raffinose family oligosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:RAFS
has exact synonym: material entity raffinose family oligosaccharide concentration

concentration of raffinose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16634
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of raffinose family oligosaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16634
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of raffinose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:RAFS
has exact synonym: material entity raffinose concentration

concentration of available carbohydrate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: available carbohydrate
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: available carbohydrate
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of available carbohydrate when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CHOAVL
database_cross_reference: INFOODs:CHOAVL-
database_cross_reference: INFOODs:CHOAVLDF
database_cross_reference: INFOODs:CHOAVLM
database_cross_reference: INFOODs:CHOAVLO
database_cross_reference: USDA_NDB:1005
has exact synonym: material entity available carbohydrate concentration

concentration of free sugar in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: free sugar
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of available carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: free sugar
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of free sugar when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:SUGAR
database_cross_reference: INFOODs:SUGAR-
database_cross_reference: INFOODs:SUGARM
database_cross_reference: USDA_NDB:1063
database_cross_reference: USDA_NDB:1235
database_cross_reference: USDA_NDB:2000
has exact synonym: material entity free sugar concentration

concentration of dietary fibre in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary fibre
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary fibre
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary fibre when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FIB-
database_cross_reference: INFOODs:FIBC
database_cross_reference: INFOODs:FIBDF
database_cross_reference: INFOODs:FIBTGLC
database_cross_reference: USDA_NDB:2033
has exact synonym: material entity dietary fibre concentration

concentration of soluble dietary fibre in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: soluble dietary fibre
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary fibre in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: soluble dietary fibre
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of soluble dietary fibre when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FIBGLCSSOL
database_cross_reference: INFOODs:PSACNSS
database_cross_reference: USDA_NDB:1082
has exact synonym: material entity soluble dietary fibre concentration

concentration of insoluble dietary fibre in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: insoluble dietary fibre
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary fibre in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: insoluble dietary fibre
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of insoluble dietary fibre when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FIBC
database_cross_reference: INFOODs:FIBGLCSINS
database_cross_reference: INFOODs:FIBGLCSINSOL
database_cross_reference: INFOODs:FIBINS
database_cross_reference: INFOODs:FIBTGLCS
database_cross_reference: USDA_NDB:1084
has exact synonym: material entity insoluble dietary fibre concentration

concentration of fructan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28796
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polysaccharide in material entity
subclass of: concentration of insoluble dietary fibre in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28796
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fructan when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FRUTN
database_cross_reference: INFOODs:FRUTNM
has exact synonym: material entity fructan concentration

concentration of protein in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36080
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36080
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of protein when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:PROT-
database_cross_reference: USDA_NDB:1003
has exact synonym: material entity protein concentration

concentration of cysteine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: cysteine
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: cysteine
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of cysteine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CYSTE
database_cross_reference: USDA_NDB:1232
has exact synonym: material entity cysteine concentration

concentration of histidine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27570
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27570
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of histidine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:HIS
database_cross_reference: USDA_NDB:1221
has exact synonym: material entity histidine concentration

concentration of leucine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25017
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25017
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of leucine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:LEU
database_cross_reference: USDA_NDB:1213
has exact synonym: material entity leucine concentration

concentration of methionine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16811
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16811
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of methionine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:MET
database_cross_reference: USDA_NDB:1215
has exact synonym: material entity methionine concentration

concentration of phenylalanine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28044
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28044
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phenylalanine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:PHE
database_cross_reference: USDA_NDB:1217
has exact synonym: material entity phenylalanine concentration

concentration of proline in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26271
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26271
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of proline when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:PRO
database_cross_reference: USDA_NDB:1226
has exact synonym: material entity proline concentration

concentration of lipid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18059
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18059
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of lipid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FATPL
database_cross_reference: USDA_NDB:1004
has exact synonym: material entity lipid concentration

concentration of propionic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_30768
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of saturated fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_30768
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of propionic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:PROPAC
has exact synonym: material entity propionic acid concentration

concentration of palmitoleic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28716
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of monounsaturated fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28716
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of palmitoleic acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity palmitoleic acid concentration

concentration of ω−3 fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25681
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyunsaturated fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25681
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of ω−3 fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity ω−3 fatty acid concentration

concentration of ω−6 fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36009
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyunsaturated fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36009
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of ω−6 fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity ω−6 fatty acid concentration

concentration of arachidonic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15843
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of ω−6 fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15843
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of arachidonic acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity arachidonic acid concentration

concentration of sterol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15889
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of lipid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15889
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sterol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:STEOTH
database_cross_reference: INFOODs:STERFRE
database_cross_reference: INFOODs:STERT
has exact synonym: material entity sterol concentration

concentration of cholesterol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16113
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of sterol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16113
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of cholesterol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CHOLEST
database_cross_reference: USDA_NDB:1253
has exact synonym: material entity cholesterol concentration

concentration of mineral nutrient in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_167164
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_167164
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of mineral nutrient when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity mineral nutrient concentration

concentration of macro element in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: macro element
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of mineral nutrient in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: macro element
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of macro element when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity macro element concentration

concentration of chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17996
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chlorine in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17996
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of chloride when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CLD
has exact synonym: material entity chloride concentration

concentration of potassium(1+) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29103
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary potassium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29103
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of potassium(1+) when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:K
database_cross_reference: USDA_NDB:1092
has exact synonym: material entity potassium(1+) concentration

concentration of trace element in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: trace element
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of mineral nutrient in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: trace element
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of trace element when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity trace element concentration

concentration of copper(2+) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29036
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary copper in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29036
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of copper(2+) when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CU
database_cross_reference: USDA_NDB:1098
has exact synonym: material entity copper(2+) concentration

concentration of fluoride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17051
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary fluorine in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17051
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fluoride when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FD
database_cross_reference: USDA_NDB:1099
has exact synonym: material entity fluoride concentration

concentration of iron(2+) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29033
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary iron in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29033
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of iron(2+) when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FE
database_cross_reference: USDA_NDB:1089
has exact synonym: material entity iron(2+) concentration

concentration of lithium(1+) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_49713
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of trace element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_49713
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of lithium(1+) when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:LI
has exact synonym: material entity lithium(1+) concentration

concentration of salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24866
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24866
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of salt when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:NACL
has exact synonym: material entity salt concentration

concentration of sodium chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26710
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic chloride in material entity
subclass of: concentration of inorganic sodium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26710
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium chloride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium chloride concentration

concentration of vitamin (molecular entity) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: vitamin (molecular entity)
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: vitamin (molecular entity)
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin (molecular entity) when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin (molecular entity) concentration

concentration of B vitamin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_75769
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_75769
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of B vitamin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity B vitamin concentration

concentration of vitamin B1 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26948
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26948
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B1 when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:THIA-
database_cross_reference: USDA_NDB:1165
has exact synonym: material entity vitamin B1 concentration

concentration of riboflavin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17015
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin B2 in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17015
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of riboflavin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:RIBF
database_cross_reference: USDA_NDB:1166
has exact synonym: material entity riboflavin concentration

concentration of nicotinic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15940
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of alkaloid in material entity
subclass of: concentration of organic acid in material entity
subclass of: concentration of vitamin B3 in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15940
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of nicotinic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:NIA-
database_cross_reference: USDA_NDB:1167
has exact synonym: material entity nicotinic acid concentration

concentration of biotin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15956
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic acid in material entity
subclass of: concentration of vitamin B7 in material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15956
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of biotin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:BIOT
database_cross_reference: USDA_NDB:1176
has exact synonym: material entity biotin concentration

concentration of folic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27470
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic acid in material entity
subclass of: concentration of vitamin B9 in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27470
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of folic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FOLAC
database_cross_reference: USDA_NDB:1186
has exact synonym: material entity folic acid concentration

concentration of vitamin C in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_176783
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_176783
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin C when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITC
database_cross_reference: INFOODs:VITC-
database_cross_reference: USDA_NDB:1162
has exact synonym: material entity vitamin C concentration

concentration of L-ascorbic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29073
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin C in material entity
subclass of: concentration of ascorbic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29073
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of L-ascorbic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:ASCL
has exact synonym: material entity L-ascorbic acid concentration

concentration of vitamin A in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: vitamin A
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: concentration of diterpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: vitamin A
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin A when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITA
database_cross_reference: INFOODs:VITA-
database_cross_reference: INFOODs:VITAA
database_cross_reference: USDA_NDB:1104
database_cross_reference: USDA_NDB:1106
has exact synonym: material entity vitamin A concentration

concentration of carotenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_23044
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of tetraterpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_23044
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of carotenoid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CARTOID
has exact synonym: material entity carotenoid concentration

concentration of β-carotene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17579
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin A in material entity
subclass of: concentration of carotene in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17579
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of β-carotene when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CARTB
database_cross_reference: USDA_NDB:1107
has exact synonym: material entity β-carotene concentration

concentration of vitamin D in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27300
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of lipid in material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27300
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin D when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITD
database_cross_reference: INFOODs:VITD-
database_cross_reference: USDA_NDB:1110
has exact synonym: material entity vitamin D concentration

concentration of vitamin E in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_33234
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_33234
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin E when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITE
database_cross_reference: INFOODs:VITE-
database_cross_reference: INFOODs:VITEA
database_cross_reference: USDA_NDB:1124
database_cross_reference: USDA_NDB:1158
database_cross_reference: USDA_NDB:1242
has exact synonym: material entity vitamin E concentration

concentration of tocopherol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27013
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin E in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27013
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of tocopherol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:TOCPHT
has exact synonym: material entity tocopherol concentration

concentration of α-tocopherol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_22470
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of tocopherol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_22470
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of α-tocopherol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:TOCPHA
database_cross_reference: USDA_NDB:1109
has exact synonym: material entity α-tocopherol concentration

concentration of vitamin K in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28384
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin (molecular entity) in material entity
subclass of: concentration of 1,4-napthoquinone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28384
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin K when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITK
has exact synonym: material entity vitamin K concentration

concentration of plant secondary metabolite in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: plant secondary metabolite
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary chemical component in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: plant secondary metabolite
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of plant secondary metabolite when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity plant secondary metabolite concentration

concentration of alkaloid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_22315
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_22315
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of alkaloid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity alkaloid concentration

concentration of caffeine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27732
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of alkaloid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27732
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of caffeine when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CAFFN
database_cross_reference: USDA_NDB:1057
has exact synonym: material entity caffeine concentration

concentration of phenols in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_33853
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of plant secondary metabolite in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_33853
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phenols when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity phenols concentration

concentration of polyphenol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26195
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26195
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of polyphenol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:POLYPHENT
has exact synonym: material entity polyphenol concentration

concentration of tannin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26848
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyphenol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26848
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of tannin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:TAN
has exact synonym: material entity tannin concentration

concentration of catechol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18135
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of benzenediols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18135
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of catechol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity catechol concentration

concentration of phenolic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_166890
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of plant secondary metabolite in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_166890
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phenolic acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity phenolic acid concentration

concentration of hydroxybenzoic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24676
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: concentration of phenolic acid in material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24676
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroxybenzoic acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroxybenzoic acid concentration

concentration of salicylic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16914
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxybenzoic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16914
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of salicylic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:SALAC
has exact synonym: material entity salicylic acid concentration

concentration of methyl ketone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_51867
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_51867
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of methyl ketone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity methyl ketone concentration

concentration of acetophenone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27632
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of methyl ketone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27632
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of acetophenone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity acetophenone concentration

concentration of naphthoquinone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25481
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25481
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of naphthoquinone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity naphthoquinone concentration

concentration of 1,4-napthoquinone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: 1,4-naphthoquinones
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of naphthoquinone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: 1,4-naphthoquinones
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of 1,4-napthoquinone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity 1,4-napthoquinone concentration

concentration of stilbenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26776
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of stilbene in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26776
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of stilbenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity stilbenoid concentration

concentration of stilbene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26775
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of plant secondary metabolite in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26775
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of stilbene when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity stilbene concentration

concentration of flavonoids in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_72544
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of plant secondary metabolite in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_72544
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavonoids when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FLAVD
has exact synonym: material entity flavonoids concentration

concentration of flavonoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_47916
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_47916
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavonoid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FLAVD
has exact synonym: material entity flavonoid concentration

concentration of flavan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_38691
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_38691
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavan when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity flavan concentration

concentration of flavanone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI 5070
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI 5070
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavanone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity flavanone concentration

concentration of naringenin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_50202
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxyflavanone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_50202
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of naringenin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:NARING
has exact synonym: material entity naringenin concentration

concentration of flavone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_42491
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavones in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_42491
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity flavone concentration

concentration of chrysin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_75095
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_75095
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of chrysin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity chrysin concentration

concentration of quercetin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16243
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16243
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of quercetin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:QUERCE
has exact synonym: material entity quercetin concentration

concentration of hydroxyflavan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_72010
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavan in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_72010
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroxyflavan when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroxyflavan concentration

concentration of catechin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_23053
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxyflavan in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_23053
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of catechin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:CATEC
database_cross_reference: INFOODs:CATECT
has exact synonym: material entity catechin concentration

concentration of isoflavonoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_50753
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_50753
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of isoflavonoid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:ISOFLVND
has exact synonym: material entity isoflavonoid concentration

concentration of isoflavones in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_38757
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of isoflavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_38757
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of isoflavones when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity isoflavones concentration

concentration of hydroxyisoflavone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_38755
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of isoflavones in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_38755
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroxyisoflavone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroxyisoflavone concentration

concentration of daidzein in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28197
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxyisoflavone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28197
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of daidzein when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:DDZEIN
has exact synonym: material entity daidzein concentration

concentration of genistein in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28088
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxyisoflavone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28088
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of genistein when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GNSTEIN
has exact synonym: material entity genistein concentration

concentration of glucoside in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24278
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of isoflavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24278
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucoside when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity glucoside concentration

concentration of phenylpropanoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26004
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of tannin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26004
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phenylpropanoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity phenylpropanoid concentration

concentration of terpenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26873
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: concentration of isoprenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26873
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of terpenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity terpenoid concentration

concentration of diterpenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_23849
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_23849
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of diterpenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity diterpenoid concentration

concentration of lycopene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_15948
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carotene in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_15948
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of lycopene when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:LYCPN
database_cross_reference: USDA_NDB:1122
has exact synonym: material entity lycopene concentration

concentration of triterpenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36615
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36615
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of triterpenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity triterpenoid concentration

concentration of organic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_64709
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_64709
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:OA
has exact synonym: material entity organic acid concentration

concentration of acetic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: acetic acid
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: acetic acid
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of acetic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:ACEAC
database_cross_reference: USDA_NDB:1026
has exact synonym: material entity acetic acid concentration

concentration of ascorbic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_22652
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of monosaccharide in material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_22652
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of ascorbic acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity ascorbic acid concentration

concentration of oxalic acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16995
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16995
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of oxalic acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:OXALAC
has exact synonym: material entity oxalic acid concentration

concentration of inositol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24848
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24848
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inositol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:INOTL
database_cross_reference: USDA_NDB:1181
has exact synonym: material entity inositol concentration

concentration of polyol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26191
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carbohydrate in material entity
subclass of: concentration of plant secondary metabolite in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26191
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of polyol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:POLYL
has exact synonym: material entity polyol concentration

concentration of mannitol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29864
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of alditol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29864
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of mannitol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:MANTL
has exact synonym: material entity mannitol concentration

concentration of glucitol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_30911
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of glucose in material entity
subclass of: concentration of alditol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_30911
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucitol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity glucitol concentration

concentration of polyunsaturated fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26208
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26208
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of polyunsaturated fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FAPU
database_cross_reference: INFOODs:FAPULC
database_cross_reference: USDA_NDB:1293
has exact synonym: material entity polyunsaturated fatty acid concentration

concentration of glycerol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17754
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of alditol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17754
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glycerol when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GLYRL
has exact synonym: material entity glycerol concentration

concentration of triglyceride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17855
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of lipid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17855
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of triglyceride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity triglyceride concentration

concentration of monounsaturated fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25413
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25413
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of monounsaturated fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: USDA_NDB:1292
has exact synonym: material entity monounsaturated fatty acid concentration

concentration of saturated fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26607
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fatty acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26607
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of saturated fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FASAT
database_cross_reference: USDA_NDB:1258
has exact synonym: material entity saturated fatty acid concentration

concentration of amylopectin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28057
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polysaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28057
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of amylopectin when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:AMYP
has exact synonym: material entity amylopectin concentration

concentration of amino acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_33709
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_33709
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of amino acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity amino acid concentration

concentration of fatty acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35366
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of lipid in material entity
subclass of: concentration of organic acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35366
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fatty acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity fatty acid concentration

concentration of glucan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_37163
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polysaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_37163
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucan when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity glucan concentration

concentration of glucose derived from sucrose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: glucose derived from sucrose
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of glucose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: glucose derived from sucrose
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucose derived from sucrose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GLUS
database_cross_reference: USDA_NDB:1011
has exact synonym: material entity glucose derived from sucrose concentration

concentration of fructose derived from sucrose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: fructose derived from sucrose
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fructose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: fructose derived from sucrose
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fructose derived from sucrose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FRUS
database_cross_reference: USDA_NDB:1012
has exact synonym: material entity fructose derived from sucrose concentration

concentration of glucose derived from maltose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: glucose derived from maltose
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of glucose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: glucose derived from maltose
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucose derived from maltose when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GLUS
database_cross_reference: USDA_NDB:1011
has exact synonym: material entity glucose derived from maltose concentration

concentration of raffinose derived from raffinose family oligosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: raffinose derived from raffinose family oligosaccharide
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of raffinose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: raffinose derived from raffinose family oligosaccharide
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of raffinose derived from raffinose family oligosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:RAFS
has exact synonym: material entity raffinose derived from raffinose family oligosaccharide concentration

concentration of glucose derived from raffinose derived from raffinose family oligosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: glucose derived from raffinose derived from raffinose family oligosaccharide
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of glucose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: glucose derived from raffinose derived from raffinose family oligosaccharide
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glucose derived from raffinose derived from raffinose family oligosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GLUS
database_cross_reference: USDA_NDB:1011
has exact synonym: material entity glucose derived from raffinose derived from raffinose family oligosaccharide concentration

concentration of fructose derived from raffinose derived from raffinose family oligosaccharide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: fructose derived from raffinose derived from raffinose family oligosaccharide
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fructose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: fructose derived from raffinose derived from raffinose family oligosaccharide
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fructose derived from raffinose derived from raffinose family oligosaccharide when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FRUS
database_cross_reference: USDA_NDB:1012
has exact synonym: material entity fructose derived from raffinose derived from raffinose family oligosaccharide concentration

concentration of inulin derived from fructan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: inulin derived from fructan
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inulin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: inulin derived from fructan
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inulin derived from fructan when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:INULN
database_cross_reference: USDA_NDB:1403
has exact synonym: material entity inulin derived from fructan concentration

concentration of fructose derived from inulin derived from fructan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: fructose derived from inulin derived from fructan
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of fructose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: fructose derived from inulin derived from fructan
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of fructose derived from inulin derived from fructan when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FRUS
database_cross_reference: USDA_NDB:1012
has exact synonym: material entity fructose derived from inulin derived from fructan concentration

concentration of amino acid derived from protein in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: amino acid derived from protein
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of amino acid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: amino acid derived from protein
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of amino acid derived from protein when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity amino acid derived from protein concentration

concentration of isoprenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24913
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of lipid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24913
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of isoprenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity isoprenoid concentration

concentration of terpene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35186
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of isoprenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35186
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of terpene when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity terpene concentration

concentration of tetraterpene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35193
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpene in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35193
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of tetraterpene when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity tetraterpene concentration

concentration of carotene in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_23042
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of carotenoid in material entity
subclass of: concentration of tetraterpene in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_23042
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of carotene when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity carotene concentration

concentration of tetraterpenoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26935
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26935
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of tetraterpenoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity tetraterpenoid concentration

concentration of methylmercury compound in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25322
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of trace element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25322
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of methylmercury compound when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity methylmercury compound concentration

concentration of thiamine hydrochloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_49105
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin B1 in material entity
subclass of: concentration of organic chloride salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_49105
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of thiamine hydrochloride when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:THIAHCL
has exact synonym: material entity thiamine hydrochloride concentration

concentration of vitamin B2 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_176838
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_176838
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B2 when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin B2 concentration

concentration of vitamin B3 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_176839
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_176839
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B3 when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin B3 concentration

concentration of vitamin B6 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27306
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27306
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B6 when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:VITB6-
database_cross_reference: USDA_NDB:1175
has exact synonym: material entity vitamin B6 concentration

concentration of vitamin B7 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_176841
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_176841
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B7 when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin B7 concentration

concentration of vitamin B9 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_176842
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of B vitamin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_176842
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin B9 when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin B9 concentration

concentration of tetrahydrofolate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_67016
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin B9 in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_67016
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of tetrahydrofolate when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:FOLH4
has exact synonym: material entity tetrahydrofolate concentration

concentration of all-trans-retinol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17336
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin A in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17336
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of all-trans-retinol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity all-trans-retinol concentration

concentration of D3 vitamins in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_73558
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin D in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_73558
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of D3 vitamins when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: USDA_NDB:1112
has exact synonym: material entity D3 vitamins concentration

concentration of vitamin D2 in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28934
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin D in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28934
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of vitamin D2 when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity vitamin D2 concentration

concentration of menadione in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28869
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin K in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28869
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of menadione when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity menadione concentration

concentration of menaquinone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16374
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin K in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16374
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of menaquinone when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:MK4
database_cross_reference: INFOODs:MK5
database_cross_reference: INFOODs:MK6
database_cross_reference: INFOODs:MK7
database_cross_reference: INFOODs:MK8
database_cross_reference: INFOODs:MK9
database_cross_reference: USDA_NDB:1183
has exact synonym: material entity menaquinone concentration

concentration of phylloquinone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18067
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of vitamin K in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18067
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phylloquinone when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: USDA_NDB:1185
has exact synonym: material entity phylloquinone concentration

concentration of dietary calcium in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary calcium
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary calcium
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary calcium when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary calcium concentration

concentration of inorganic calcium salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_190295
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary calcium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_190295
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic calcium salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic calcium salt concentration

concentration of calcium carbonate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI 3311
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic calcium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI 3311
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of calcium carbonate when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity calcium carbonate concentration

concentration of calcium sulfate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_31346
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic calcium salt in material entity
subclass of: concentration of inorganic sulfate salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_31346
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of calcium sulfate when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity calcium sulfate concentration

concentration of calcium hydroxide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35150
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic calcium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35150
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of calcium hydroxide when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity calcium hydroxide concentration

concentration of dietary chlorine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary chlorine
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary chlorine
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary chlorine when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary chlorine concentration

concentration of inorganic chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36093
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of chloride in material entity
subclass of: concentration of salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36093
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic chloride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic chloride concentration

concentration of potassium chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_32588
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic chloride in material entity
subclass of: concentration of inorganic potassium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_32588
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of potassium chloride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity potassium chloride concentration

concentration of lithium chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_48607
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic chloride in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_48607
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of lithium chloride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity lithium chloride concentration

concentration of organic chloride salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36094
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of chloride in material entity
subclass of: concentration of salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36094
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organic chloride salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity organic chloride salt concentration

concentration of organochlorine compound in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36683
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of chloride in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36683
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organochlorine compound when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity organochlorine compound concentration

concentration of hydrogen chloride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17883
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of chloride in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17883
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydrogen chloride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydrogen chloride concentration

concentration of hypochlorite in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_29222
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of chloride in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_29222
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hypochlorite when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hypochlorite concentration

concentration of dietary magnesium in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary magnesium
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary magnesium
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary magnesium when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary magnesium concentration

concentration of inorganic magnesium salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_190297
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary magnesium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_190297
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic magnesium salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic magnesium salt concentration

concentration of magnesium hydroxide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_35149
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic magnesium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_35149
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of magnesium hydroxide when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity magnesium hydroxide concentration

concentration of dietary phosphorus in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary phosphorus
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary phosphorus
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary phosphorus when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary phosphorus concentration

concentration of phosphoric acid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26078
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary phosphorus in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26078
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of phosphoric acid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity phosphoric acid concentration

concentration of inorganic phosphate salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_190300
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary phosphorus in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_190300
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic phosphate salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic phosphate salt concentration

concentration of sodium phosphate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_37586
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic phosphate salt in material entity
subclass of: concentration of inorganic sodium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_37586
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium phosphate when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium phosphate concentration

concentration of dietary potassium in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary potassium
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary potassium
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary potassium when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary potassium concentration

concentration of inorganic potassium salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_190303
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary potassium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_190303
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic potassium salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic potassium salt concentration

concentration of dietary sodium in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary sodium
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary sodium
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary sodium when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary sodium concentration

concentration of inorganic sodium salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_38702
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary sodium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_38702
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic sodium salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic sodium salt concentration

concentration of sodium sulfate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_32149
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic sodium salt in material entity
subclass of: concentration of inorganic sulfate salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_32149
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium sulfate when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium sulfate concentration

concentration of sodium hydrogensulfite in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_26709
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of sodium sulfate in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_26709
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium hydrogensulfite when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium hydrogensulfite concentration

concentration of sodium fluoride in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28741
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic sodium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28741
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium fluoride when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium fluoride concentration

concentration of sodium hydroxide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_32145
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic sodium salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_32145
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sodium hydroxide when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sodium hydroxide concentration

concentration of organic sodium salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_38700
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary sodium in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_38700
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organic sodium salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity organic sodium salt concentration

concentration of dietary sulfur in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary sulfur
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of macro element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary sulfur
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary sulfur when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary sulfur concentration

concentration of inorganic sulfate salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24840
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of salt in material entity
subclass of: concentration of dietary sulfur in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24840
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic sulfate salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic sulfate salt concentration

concentration of iron(2+) sulfate (anhydrous) in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_75832
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of inorganic sulfate salt in material entity
subclass of: concentration of inorganic iron salt in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_75832
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of iron(2+) sulfate (anhydrous) when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity iron(2+) sulfate (anhydrous) concentration

concentration of organic sulfate in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_25704
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary sulfur in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_25704
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organic sulfate when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity organic sulfate concentration

concentration of organosulfur compound in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_33261
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary sulfur in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_33261
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of organosulfur compound when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity organosulfur compound concentration

concentration of glutathione in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_16856
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_16856
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of glutathione when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity glutathione concentration

concentration of dimethyl sulfoxide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28262
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28262
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dimethyl sulfoxide when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dimethyl sulfoxide concentration

concentration of sulfur dioxide in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18422
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organosulfur compound in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18422
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of sulfur dioxide when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity sulfur dioxide concentration

concentration of dietary copper in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary copper
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of trace element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary copper
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary copper when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary copper concentration

concentration of dietary fluorine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary fluorine
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of trace element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary fluorine
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary fluorine when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary fluorine concentration

concentration of dietary iron in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: dietary iron
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of trace element in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: dietary iron
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dietary iron when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dietary iron concentration

concentration of inorganic iron salt in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_190420
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of dietary iron in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_190420
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of inorganic iron salt when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity inorganic iron salt concentration

concentration of gum in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: gum
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polysaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: gum
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of gum when measured in some material entity.
IAO_0000412: cdno.owl
database_cross_reference: INFOODs:GUMS
has exact synonym: material entity gum concentration

concentration of carrageenan in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI 3435
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of organic sulfate in material entity
subclass of: concentration of gum in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI 3435
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of carrageenan when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity carrageenan concentration

concentration of ketose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24978
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of monosaccharide in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24978
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of ketose when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity ketose concentration

concentration of ketohexose in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24973
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of ketose in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24973
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of ketohexose when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity ketohexose concentration

concentration of alditol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17522
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyol in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17522
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of alditol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity alditol concentration

concentration of curcumin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI 3962
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyphenol in material entity
subclass of: concentration of diarylheptanoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI 3962
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of curcumin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity curcumin concentration

concentration of stilbenol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_36027
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: concentration of stilbenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_36027
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of stilbenol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity stilbenol concentration

concentration of benzenediols in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_33570
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_33570
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of benzenediols when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity benzenediols concentration

concentration of hydroquinone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17594
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of benzenediols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17594
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroquinone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroquinone concentration

concentration of dopamine in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_18243
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of benzenediols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_18243
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of dopamine when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity dopamine concentration

concentration of resorcinol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27810
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of benzenediols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27810
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of resorcinol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity resorcinol concentration

concentration of serotonin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28790
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28790
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of serotonin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity serotonin concentration

concentration of biphenyl-2-ol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17043
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of phenols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17043
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of biphenyl-2-ol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity biphenyl-2-ol concentration

concentration of anthoxanthin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_192499
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_192499
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of anthoxanthin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity anthoxanthin concentration

concentration of flavones in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24043
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of anthoxanthin in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24043
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavones when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity flavones concentration

concentration of hydroxyflavone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24698
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24698
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroxyflavone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroxyflavone concentration

concentration of flavonols in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_28802
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of hydroxyflavone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_28802
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of flavonols when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity flavonols concentration

concentration of hydroxyflavanone in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_24697
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavanone in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_24697
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of hydroxyflavanone when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity hydroxyflavanone concentration

concentration of equol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_34741
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of isoflavonoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_34741
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of equol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity equol concentration

concentration of resveratrol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_27881
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of polyphenol in material entity
subclass of: concentration of stilbenol in material entity
subclass of: concentration of benzenediols in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_27881
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of resveratrol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity resveratrol concentration

concentration of diosgenin in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI 4629
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of triterpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI 4629
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of diosgenin when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity diosgenin concentration

concentration of geraniol in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17447
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17447
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of geraniol when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity geraniol concentration

concentration of all-trans-retinal in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_17898
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of terpenoid in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_17898
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of all-trans-retinal when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity all-trans-retinal concentration

concentration of diarylheptanoid in material entity
type: Class
equivalent class: Class
  intersection of: PATO_0000033
  intersection of: Restriction
    on property: characteristic of
    some values from: Class
      intersection of: CHEBI_78802
      intersection of: Restriction
        on property: part of
        some values from: material entity
subclass of: concentration of flavonoids in material entity
subclass of: Restriction
  on property: characteristic of
  some values from: Class
    intersection of: CHEBI_78802
    intersection of: Restriction
      on property: part of
      some values from: material entity
definition: The concentration of diarylheptanoid when measured in some material entity.
IAO_0000412: cdno.owl
has exact synonym: material entity diarylheptanoid concentration

deoxynivalenol
type: Class
subclass of: CHEBI_15734
subclass of: CHEBI 2468
subclass of: CHEBI_27136
subclass of: CHEBI 3992
subclass of: CHEBI_51689
subclass of: CHEBI_55517
definition: A trichothecene mycotoxin produced by Fusarium to which wheat, barley, maize (corn) and their products are susceptible to contamination.
charge: 0
formula: C15H20O6
inchi: InChI=1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1
inchikey: LINOMUASTDIRTM-QGRHZQQGSA-N
mass: 296.319
monoisotopicmass: 296.12599
database_cross_reference: CAS:51481-10-8
database_cross_reference: Chemspider:36584
database_cross_reference: KEGG:C09747
database_cross_reference: KNApSAcK:C00003201
database_cross_reference: LIPID_MAPS_instance:LMPR0103180002
database_cross_reference: PMID:28780485
database_cross_reference: PMID:30284112
database_cross_reference: PMID:30714884
database_cross_reference: PMID:30760085
database_cross_reference: PMID:30802751
database_cross_reference: PMID:30806951
database_cross_reference: PMID:30841652
database_cross_reference: PMID:31394401
database_cross_reference: PMID:31817218
database_cross_reference: PMID:31867960
database_cross_reference: PMID:31960350
database_cross_reference: PMID:32218143
database_cross_reference: PMID:32260237
database_cross_reference: PMID:32560237
database_cross_reference: PMID:32745571
database_cross_reference: PMID:32805342
database_cross_reference: PMID:32851525
database_cross_reference: PMID:32880717
database_cross_reference: PMID:32930227
database_cross_reference: Wikipedia:Vomitoxin
has exact synonym: 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
has OBO namespace: chebi_ontology
has related synonym: 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
has related synonym: 4-Deoxynivalenol
has related synonym: 4-Desoxynivalenol
has related synonym: DON
has related synonym: Dehydronivalenol
has related synonym: Desoxynivalenol
has related synonym: Vomitoxin
id: CHEBI:10022
in subset: 3 STAR

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: CAS:51481-10-8
source: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: CAS:51481-10-8
source: KEGG COMPOUND

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: LIPID_MAPS_instance:LMPR0103180002
source: LIPID MAPS

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:28780485
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30284112
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30714884
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30760085
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30802751
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30806951
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:30841652
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:31394401
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:31817218
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:31867960
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:31960350
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32218143
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32260237
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32560237
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32745571
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32805342
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32851525
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32880717
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: database_cross_reference
annotated target: PMID:32930227
source: Europe PMC

Axiom
annotated source: deoxynivalenol
annotated property: has exact synonym
annotated target: 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: 3alpha,7alpha,15-trihydroxy-12,13-epoxytrichothec-9-en-8-one
database_cross_reference: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: 4-Deoxynivalenol
database_cross_reference: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: 4-Desoxynivalenol
database_cross_reference: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: DON
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: Dehydronivalenol
database_cross_reference: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: Desoxynivalenol
database_cross_reference: ChemIDplus

Axiom
annotated source: deoxynivalenol
annotated property: hasRelatedSynonym
annotated target: Vomitoxin
database_cross_reference: KEGG_COMPOUND

ciprofloxacin
type: Class
subclass of: CHEBI_23765
subclass of: CHEBI_26512
subclass of: CHEBI_36709
subclass of: CHEBI_46848
subclass of: CHEBI_51454
subclass of: CHEBI_86324
subclass of: CHEBI_87211
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_36047
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50750
subclass of: Restriction
  on property: has role
  some values from: CHEBI_53559
subclass of: Restriction
  on property: has role
  some values from: CHEBI_59517
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_192486
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_192484
definition: A quinolone that is quinolin-4(1H)-one bearing cyclopropyl, carboxylic acid, fluoro and piperazin-1-yl substituents at positions 1, 3, 6 and 7, respectively.
charge: 0
formula: C17H18FN3O3
inchi: InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)
inchikey: MYSWGUAQZAJSOK-UHFFFAOYSA-N
mass: 331.34150
monoisotopicmass: 331.13322
has alternative id: CHEBI:102718
has alternative id: CHEBI:3717
has alternative id: CHEBI:41638
database_cross_reference: Beilstein:3568352
database_cross_reference: CAS:85721-33-1
database_cross_reference: DrugBank:DB00537
database_cross_reference: Drug_Central:659
database_cross_reference: HMDB:HMDB0014677
database_cross_reference: KEGG:C05349
database_cross_reference: KEGG:D00186
database_cross_reference: LINCS:LSM-5226
database_cross_reference: PDBeChem:CPF
database_cross_reference: PMID:10397494
database_cross_reference: PMID:10737746
database_cross_reference: Patent:DE3142854
database_cross_reference: Patent:US4670444
database_cross_reference: Reaxys:3568352
database_cross_reference: VSDB:1763
database_cross_reference: Wikipedia:Ciprofloxacin
has exact synonym: 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
has exact synonym: Ciprofloxacin
has exact synonym: ciprofloxacin
has OBO namespace: chebi_ontology
has related synonym: 1-CYCLOPROPYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID
has related synonym: 1-Cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-quinoline-3-carboxylic acid
has related synonym: 1-Cyclopropyl-6-fluoro-7-(4-methyl-piperazin-1-yl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid
has related synonym: 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
has related synonym: 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
has related synonym: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
has related synonym: 1-cyclopropyl-6-fluoro-7-hexahydro-1-pyrazinyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
has related synonym: ciprofloxacin
has related synonym: ciprofloxacine
has related synonym: ciprofloxacino
has related synonym: ciprofloxacinum
id: CHEBI:100241
in subset: 3 STAR

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: Beilstein:3568352
source: Beilstein

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: CAS:85721-33-1
source: ChemIDplus

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: CAS:85721-33-1
source: KEGG COMPOUND

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: Drug_Central:659
source: DrugCentral

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: PMID:10397494
source: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: PMID:10737746
source: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: database_cross_reference
annotated target: Reaxys:3568352
source: Reaxys

Axiom
annotated source: ciprofloxacin
annotated property: has exact synonym
annotated target: 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: ciprofloxacin
annotated property: has exact synonym
annotated target: Ciprofloxacin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: ciprofloxacin
annotated property: has exact synonym
annotated target: ciprofloxacin
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-CYCLOPROPYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID
database_cross_reference: PDBeChem

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-Cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-quinoline-3-carboxylic acid
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-Cyclopropyl-6-fluoro-7-(4-methyl-piperazin-1-yl)-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-cyclopropyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: 1-cyclopropyl-6-fluoro-7-hexahydro-1-pyrazinyl-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
database_cross_reference: ChEMBL

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: ciprofloxacin
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: ciprofloxacine
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: ciprofloxacino
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: ciprofloxacin
annotated property: hasRelatedSynonym
annotated target: ciprofloxacinum
database_cross_reference: ChemIDplus
has synonym type: INN

norfloxacin
type: Class
subclass of: CHEBI_23765
subclass of: CHEBI_26512
subclass of: CHEBI_46848
subclass of: CHEBI_86324
subclass of: CHEBI_87211
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_36047
subclass of: Restriction
  on property: has role
  some values from: CHEBI_59517
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: A quinolinemonocarboxylic acid with broad-spectrum antibacterial activity against most gram-negative and gram-positive bacteria. Norfloxacin is bactericidal and its mode of action depends on blocking of bacterial DNA replication by binding itself to an enzyme called DNA gyrase.
charge: 0
formula: C16H18FN3O3
inchi: InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)
inchikey: OGJPXUAPXNRGGI-UHFFFAOYSA-N
mass: 319.33080
monoisotopicmass: 319.13322
has alternative id: CHEBI:7629
database_cross_reference: Beilstein:567897
database_cross_reference: CAS:70458-96-7
database_cross_reference: DrugBank:DB01059
database_cross_reference: Drug_Central:1967
database_cross_reference: Gmelin:1576626
database_cross_reference: HMDB:HMDB0015192
database_cross_reference: KEGG:C06687
database_cross_reference: KEGG:D00210
database_cross_reference: LINCS:LSM-5286
database_cross_reference: PMID:3317294
database_cross_reference: PMID:3908074
database_cross_reference: PMID:6211142
database_cross_reference: PMID:6224685
database_cross_reference: PMID:6234465
database_cross_reference: PMID:6454381
database_cross_reference: PMID:6461606
database_cross_reference: Patent:BE863429
database_cross_reference: Patent:DE2840910
database_cross_reference: Patent:US4146719
database_cross_reference: Patent:US4292317
database_cross_reference: Reaxys:567897
database_cross_reference: VSDB:1831
database_cross_reference: Wikipedia:Norfloxacin
has exact synonym: 1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
has OBO namespace: chebi_ontology
has related synonym: 1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
has related synonym: 1-Ethyl-6-fluor-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-chinolincarbonsaeure
has related synonym: 1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
has related synonym: NFLX
has related synonym: norfloxacin
has related synonym: norfloxacine
has related synonym: norfloxacino
has related synonym: norfloxacinum
id: CHEBI:100246
in subset: 3 STAR

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: Beilstein:567897
source: Beilstein

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: CAS:70458-96-7
source: ChemIDplus

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: CAS:70458-96-7
source: KEGG COMPOUND

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: Drug_Central:1967
source: DrugCentral

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: Gmelin:1576626
source: Gmelin

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:3317294
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:3908074
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:6211142
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:6224685
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:6234465
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:6454381
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: PMID:6461606
source: Europe PMC

Axiom
annotated source: norfloxacin
annotated property: database_cross_reference
annotated target: Reaxys:567897
source: Reaxys

Axiom
annotated source: norfloxacin
annotated property: has exact synonym
annotated target: 1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: 1,4-Dihydro-1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: 1-Ethyl-6-fluor-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-chinolincarbonsaeure
database_cross_reference: ChemIDplus

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: 1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: NFLX
database_cross_reference: KEGG_DRUG

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: norfloxacin
database_cross_reference: KEGG_DRUG
has synonym type: INN

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: norfloxacine
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: norfloxacino
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: norfloxacin
annotated property: hasRelatedSynonym
annotated target: norfloxacinum
database_cross_reference: ChemIDplus
has synonym type: INN

warfarin
type: Class
subclass of: CHEBI_60911
subclass of: Restriction
  on property: has part
  some values from: CHEBI_87737
subclass of: Restriction
  on property: has part
  some values from: CHEBI_87738
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33288
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50249
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50390
subclass of: Restriction
  on property: has role
  some values from: CHEBI_55347
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_50393
definition: A racemate comprising equal amounts of (R)- and (S)-warfarin. Extensively used as both an anticoagulant drug and as a pesticide against rats and mice.
database_cross_reference: Beilstein:1293536
database_cross_reference: CAS:81-81-2
database_cross_reference: DrugBank:DB00682
database_cross_reference: HMDB:HMDB0001935
database_cross_reference: KEGG:C01541
database_cross_reference: KEGG:D08682
database_cross_reference: PMID:13358873
database_cross_reference: PMID:15578879
database_cross_reference: PMID:18294321
database_cross_reference: PMID:19294412
database_cross_reference: PMID:24478171
database_cross_reference: PMID:24973057
database_cross_reference: PMID:25022924
database_cross_reference: PMID:25023204
database_cross_reference: PMID:25393417
database_cross_reference: PMID:25466603
database_cross_reference: PMID:25534862
database_cross_reference: PMID:25537751
database_cross_reference: PMID:25555316
database_cross_reference: PMID:25683623
database_cross_reference: PMID:25757926
database_cross_reference: PMID:25823787
database_cross_reference: PMID:25828628
database_cross_reference: PMID:25830869
database_cross_reference: PMID:25842804
database_cross_reference: PMID:25845131
database_cross_reference: PMID:25986145
database_cross_reference: PMID:26114209
database_cross_reference: PMID:26142522
database_cross_reference: PMID:26142525
database_cross_reference: PMID:26203765
database_cross_reference: PMID:26238769
database_cross_reference: Patent:US2427578
database_cross_reference: Patent:US2765321
database_cross_reference: Patent:US2777859
database_cross_reference: Patent:US3239529
database_cross_reference: Reaxys:1293536
database_cross_reference: Wikipedia:Warfarin
has exact synonym: rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one
has OBO namespace: chebi_ontology
has related synonym: (+/-)-Warfarin
has related synonym: (Phenyl-1 acetyl-2 ethyl) 3-hydroxy-4 coumarine
has related synonym: (RS)-Warfarin
has related synonym: 1-(4'-Hydroxy-3'-coumarinyl)-1-phenyl-3-butanone
has related synonym: 2H-1-Benzopyran-2-one, 4-hydroxy-3-(3-oxo-1-phenylbutyl)-
has related synonym: 3-(1'-Phenyl-2'-acetylethyl)-4-hydroxycoumarin
has related synonym: 3-(Acetonylbenzyl)-4-hydroxycoumarin
has related synonym: 3-(Alpha-acetonylbenzyl)-4-hydroxycoumarin
has related synonym: 3-(alpha-Phenyl-beta-acetylaethyl)-4-hydroxycumarin
has related synonym: 3-(alpha-Phenyl-beta-acetylethyl)-4-hydroxycoumarin
has related synonym: 4-Hydroxy-3-(3-oxo-1-phenyl-butyl)-cumarin
has related synonym: 4-Hydroxy-3-(3-oxo-1-phenylbutyl)coumarin
has related synonym: Coumafene
has related synonym: DL-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin
has related synonym: DL-warfarin
has related synonym: Warf 10
has related synonym: Zoocoumarin
has related synonym: rac-warfarin
has related synonym: racemic warfarin
has related synonym: warfarin
has related synonym: warfarina
has related synonym: warfarine
has related synonym: warfarinum
id: CHEBI:10033
in subset: 3 STAR

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: Beilstein:1293536
source: Beilstein

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: CAS:81-81-2
source: ChemIDplus

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: CAS:81-81-2
source: KEGG COMPOUND

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: CAS:81-81-2
source: NIST Chemistry WebBook

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:13358873
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:15578879
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:18294321
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:19294412
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:24478171
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:24973057
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25022924
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25023204
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25393417
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25466603
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25534862
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25537751
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25555316
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25683623
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25757926
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25823787
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25828628
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25830869
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25842804
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25845131
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:25986145
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:26114209
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:26142522
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:26142525
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:26203765
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: PMID:26238769
source: Europe PMC

Axiom
annotated source: warfarin
annotated property: database_cross_reference
annotated target: Reaxys:1293536
source: Reaxys

Axiom
annotated source: warfarin
annotated property: has exact synonym
annotated target: rac-4-hydroxy-3-(3-oxo-1-phenylbutyl)-2H-1-benzopyran-2-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: (+/-)-Warfarin
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: (Phenyl-1 acetyl-2 ethyl) 3-hydroxy-4 coumarine
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: (RS)-Warfarin
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 1-(4'-Hydroxy-3'-coumarinyl)-1-phenyl-3-butanone
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 2H-1-Benzopyran-2-one, 4-hydroxy-3-(3-oxo-1-phenylbutyl)-
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 3-(1'-Phenyl-2'-acetylethyl)-4-hydroxycoumarin
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 3-(Acetonylbenzyl)-4-hydroxycoumarin
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 3-(Alpha-acetonylbenzyl)-4-hydroxycoumarin
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 3-(alpha-Phenyl-beta-acetylaethyl)-4-hydroxycumarin
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 3-(alpha-Phenyl-beta-acetylethyl)-4-hydroxycoumarin
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 4-Hydroxy-3-(3-oxo-1-phenyl-butyl)-cumarin
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: 4-Hydroxy-3-(3-oxo-1-phenylbutyl)coumarin
database_cross_reference: ChEBI

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: Coumafene
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: DL-3-(alpha-acetonylbenzyl)-4-hydroxycoumarin
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: DL-warfarin
database_cross_reference: ChEBI

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: Warf 10
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: Zoocoumarin
database_cross_reference: ChemIDplus

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: rac-warfarin
database_cross_reference: ChEBI

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: racemic warfarin
database_cross_reference: ChEBI

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: warfarin
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: warfarina
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: warfarine
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: warfarin
annotated property: hasRelatedSynonym
annotated target: warfarinum
database_cross_reference: ChemIDplus
has synonym type: INN

ziprasidone
type: Class
subclass of: CHEBI_24829
subclass of: CHEBI_26144
subclass of: CHEBI_36683
subclass of: CHEBI_55505
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35476
subclass of: Restriction
  on property: has role
  some values from: CHEBI_37956
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48279
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48561
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48876
definition: A piperazine compound having 1,2-benzothiazol-3-yl- and 2-(6-chloro-1,3-dihydro-2-oxindol-5-yl)ethyl substituents attached to the nitrogen atoms.
charge: 0
formula: C21H21ClN4OS
inchi: InChI=1S/C21H21ClN4OS/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)
inchikey: MVWVFYHBGMAFLY-UHFFFAOYSA-N
mass: 412.93600
monoisotopicmass: 412.11246
database_cross_reference: Beilstein:6669199
database_cross_reference: CAS:146939-27-7
database_cross_reference: DrugBank:DB00246
database_cross_reference: Drug_Central:2865
database_cross_reference: KEGG:C07568
database_cross_reference: KEGG:D08687
database_cross_reference: LINCS:LSM-5433
database_cross_reference: Patent:EP281309
database_cross_reference: Patent:US4831031
database_cross_reference: Wikipedia:Ziprasidone
has exact synonym: 5-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one
has exact synonym: Ziprasidone
has OBO namespace: chebi_ontology
has related synonym: ziprasidona
has related synonym: ziprasidone
has related synonym: ziprasidonum
id: CHEBI:10119
in subset: 3 STAR

Axiom
annotated source: ziprasidone
annotated property: database_cross_reference
annotated target: Beilstein:6669199
source: Beilstein

Axiom
annotated source: ziprasidone
annotated property: database_cross_reference
annotated target: CAS:146939-27-7
source: ChemIDplus

Axiom
annotated source: ziprasidone
annotated property: database_cross_reference
annotated target: CAS:146939-27-7
source: DrugBank

Axiom
annotated source: ziprasidone
annotated property: database_cross_reference
annotated target: CAS:146939-27-7
source: KEGG DRUG

Axiom
annotated source: ziprasidone
annotated property: database_cross_reference
annotated target: Drug_Central:2865
source: DrugCentral

Axiom
annotated source: ziprasidone
annotated property: has exact synonym
annotated target: 5-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-6-chloro-1,3-dihydro-2H-indol-2-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: ziprasidone
annotated property: has exact synonym
annotated target: Ziprasidone
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: ziprasidone
annotated property: hasRelatedSynonym
annotated target: ziprasidona
database_cross_reference: ChEBI
has synonym type: INN

Axiom
annotated source: ziprasidone
annotated property: hasRelatedSynonym
annotated target: ziprasidone
database_cross_reference: ChEBI
has synonym type: INN

Axiom
annotated source: ziprasidone
annotated property: hasRelatedSynonym
annotated target: ziprasidone
database_cross_reference: KEGG_DRUG
has synonym type: INN

Axiom
annotated source: ziprasidone
annotated property: hasRelatedSynonym
annotated target: ziprasidonum
database_cross_reference: ChEBI
has synonym type: INN

diltiazem
type: Class
subclass of: CHEBI_82814
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35620
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35674
subclass of: Restriction
  on property: has role
  some values from: CHEBI_38215
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_82812
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_82813
definition: A 5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate in which both stereocentres have S configuration. A calcium-channel blocker and vasodilator, it is used as the hydrochloride in the management of angina pectoris and hypertension.
charge: 0
formula: C22H26N2O4S
inchi: InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1
inchikey: HSUGRBWQSSZJOP-RTWAWAEBSA-N
mass: 414.51800
monoisotopicmass: 414.16133
has alternative id: CHEBI:4602
database_cross_reference: Beilstein:3573079
database_cross_reference: CAS:42399-41-7
database_cross_reference: DrugBank:DB00343
database_cross_reference: Drug_Central:897
database_cross_reference: HMDB:HMDB0014487
database_cross_reference: KEGG:C06958
database_cross_reference: KEGG:D07845
database_cross_reference: LINCS:LSM-2523
database_cross_reference: PMID:11937779
database_cross_reference: PMID:16651034
database_cross_reference: PMID:19167257
database_cross_reference: PMID:23687551
database_cross_reference: PMID:24261918
database_cross_reference: PMID:25122162
database_cross_reference: PMID:8369596
database_cross_reference: Patent:DE1805714
database_cross_reference: Patent:DE3415035
database_cross_reference: Patent:US3562257
database_cross_reference: Patent:US4552695
database_cross_reference: Reaxys:3573079
database_cross_reference: VSDB:1863
database_cross_reference: Wikipedia:Diltiazem
has exact synonym: (2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
has OBO namespace: chebi_ontology
has related synonym: (+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester
has related synonym: (2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate
has related synonym: (2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
has related synonym: Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester
has related synonym: D-cis-diltiazem
has related synonym: d-cis-diltiazem
has related synonym: diltiazem
has related synonym: diltiazemum
id: CHEBI:101278
in subset: 3 STAR

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: Beilstein:3573079
source: Beilstein

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: CAS:42399-41-7
source: ChemIDplus

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: CAS:42399-41-7
source: KEGG COMPOUND

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: CAS:42399-41-7
source: NIST Chemistry WebBook

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: Drug_Central:897
source: DrugCentral

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:11937779
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:16651034
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:19167257
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:23687551
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:24261918
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:25122162
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: PMID:8369596
source: Europe PMC

Axiom
annotated source: diltiazem
annotated property: database_cross_reference
annotated target: Reaxys:3573079
source: Reaxys

Axiom
annotated source: diltiazem
annotated property: has exact synonym
annotated target: (2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: (+)-cis-5-[2-(dimethylamino)ethyl]-2,3-dihydro-3-hydroxy-2-(p-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one acetate ester
database_cross_reference: ChEBI

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: (2S,3S)-5-(2-(dimethylamino)ethyl)-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-3-yl acetate
database_cross_reference: ChEMBL

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: (2S-cis)-3-(acetyloxy)-5-[2-(dimethylamino)ethyl]-2,3-dihydro-2-(4-methoxyphenyl)-1,5-benzothiazepin-4(5H)-one
database_cross_reference: ChEBI

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: Acetic acid (2S,3S)-5-(2-dimethylamino-ethyl)-2-(4-methoxy-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepin-3-yl ester
database_cross_reference: ChEMBL

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: D-cis-diltiazem
database_cross_reference: ChEBI

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: d-cis-diltiazem
database_cross_reference: ChEBI

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: diltiazem
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: diltiazem
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: diltiazem
annotated property: hasRelatedSynonym
annotated target: diltiazemum
database_cross_reference: ChemIDplus
has synonym type: INN

thiopental
type: Class
subclass of: CHEBI_22693
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35623
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35717
subclass of: Restriction
  on property: has role
  some values from: CHEBI_38877
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
subclass of: Restriction
  on property: has role
  some values from: CHEBI_88188
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_33202
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_61485
definition: A barbiturate, the structure of which is that of 2-thiobarbituric acid substituted at C-5 by ethyl and sec-pentyl groups.
charge: 0
formula: C11H18N2O2S
inchi: InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
inchikey: IUJDSEJGGMCXSG-UHFFFAOYSA-N
mass: 242.33800
monoisotopicmass: 242.10890
smiles: CCCC(C)C1(CC)C(=O)NC(=S)NC1=O
has alternative id: CHEBI:9560
database_cross_reference: Beilstein:209361
database_cross_reference: CAS:76-75-5
database_cross_reference: DrugBank:DB00599
database_cross_reference: Drug_Central:2633
database_cross_reference: KEGG:C07521
database_cross_reference: PMID:10666006
database_cross_reference: PMID:10841799
database_cross_reference: PMID:15857133
database_cross_reference: PMID:16166909
database_cross_reference: PMID:16897573
database_cross_reference: PMID:18484074
database_cross_reference: PMID:20488867
database_cross_reference: PMID:2215478
database_cross_reference: PMID:23305916
database_cross_reference: PMID:23422796
database_cross_reference: PMID:23490495
database_cross_reference: PMID:23542731
database_cross_reference: PMID:23644730
database_cross_reference: PMID:23879844
database_cross_reference: PMID:3654008
database_cross_reference: PMID:6864729
database_cross_reference: PMID:9171876
database_cross_reference: PMID:9699097
database_cross_reference: Reaxys:209361
has exact synonym: 5-ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
has exact synonym: Thiopental
has OBO namespace: chebi_ontology
has related synonym: (+-)-thiopental
has related synonym: 2-Thio-5-ethyl-5-sec-pentylbarbituric acid
has related synonym: 5-Ethyl-5-(1-methyl-butyl)-2-thioxo-dihydro-pyrimidine-4,6-dione
has related synonym: Penthiobarbital
has related synonym: Pentothiobarbital
has related synonym: Thiopentobarbital
has related synonym: Thiopentobarbitone
has related synonym: Thiopentobarbituric acid
has related synonym: Thiopentone
id: CHEBI:102166
in subset: 3 STAR

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: Beilstein:209361
source: Beilstein

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: CAS:76-75-5
source: ChemIDplus

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: CAS:76-75-5
source: KEGG COMPOUND

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: Drug_Central:2633
source: DrugCentral

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:10666006
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:10841799
source: ChEMBL

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:15857133
source: ChEMBL

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:16166909
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:16897573
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:18484074
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:20488867
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:2215478
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23305916
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23422796
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23490495
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23542731
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23644730
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:23879844
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:3654008
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:6864729
source: ChEMBL

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:9171876
source: ChEMBL

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: PMID:9699097
source: Europe PMC

Axiom
annotated source: thiopental
annotated property: database_cross_reference
annotated target: Reaxys:209361
source: Reaxys

Axiom
annotated source: thiopental
annotated property: has exact synonym
annotated target: 5-ethyl-5-(pentan-2-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: thiopental
annotated property: has exact synonym
annotated target: Thiopental
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: (+-)-thiopental
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: 2-Thio-5-ethyl-5-sec-pentylbarbituric acid
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: 5-Ethyl-5-(1-methyl-butyl)-2-thioxo-dihydro-pyrimidine-4,6-dione
database_cross_reference: ChEMBL

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Penthiobarbital
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Pentothiobarbital
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Thiopentobarbital
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Thiopentobarbitone
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Thiopentobarbituric acid
database_cross_reference: ChemIDplus

Axiom
annotated source: thiopental
annotated property: hasRelatedSynonym
annotated target: Thiopentone
database_cross_reference: ChemIDplus

sulfamethazine
type: Class
subclass of: CHEBI_39447
subclass of: CHEBI_87228
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_36047
definition: A sulfonamide consisting of pyrimidine with methyl substituents at the 4- and 6-positions and a 4-aminobenzenesulfonamido group at the 2-position.
charge: 0
formula: C12H14N4O2S
inchi: InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)
inchikey: ASWVTGNCAZCNNR-UHFFFAOYSA-N
mass: 278.33000
monoisotopicmass: 278.08375
smiles: Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1
database_cross_reference: Beilstein:261304
database_cross_reference: CAS:57-68-1
database_cross_reference: DrugBank:DB01582
database_cross_reference: Drug_Central:2502
database_cross_reference: Gmelin:1009759
database_cross_reference: HMDB:HMDB0015522
database_cross_reference: KEGG:C19530
database_cross_reference: KEGG:D02436
database_cross_reference: LINCS:LSM-5295
database_cross_reference: PMID:11431418
database_cross_reference: PMID:14552772
database_cross_reference: PMID:15603963
database_cross_reference: PMID:17311370
database_cross_reference: PMID:17596632
database_cross_reference: PMID:20028131
database_cross_reference: PMID:22903812
database_cross_reference: PMID:23218311
database_cross_reference: PMID:23384282
database_cross_reference: PMID:23434485
database_cross_reference: PMID:23454458
database_cross_reference: PMID:23562141
database_cross_reference: PMID:23636590
database_cross_reference: PMID:23673752
database_cross_reference: PMID:23673946
database_cross_reference: PMID:23704574
database_cross_reference: PMID:6864729
database_cross_reference: PMID:7021831
database_cross_reference: PMID:7328159
database_cross_reference: PMID:8199304
database_cross_reference: PMID:9886437
database_cross_reference: Patent:EP1861101
database_cross_reference: Patent:GB546158
database_cross_reference: Patent:GB552887
database_cross_reference: Patent:US2407966
database_cross_reference: Patent:US3119818
database_cross_reference: Patent:WO2005016386
database_cross_reference: Reaxys:261304
database_cross_reference: VSDB:1829
database_cross_reference: Wikipedia:Sulfadimidine
has exact synonym: 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
has OBO namespace: chebi_ontology
has related synonym: (p-Aminobenzolsulfonyl)-2-amino-4,6-dimethylpyrimidin
has related synonym: 2-(4-Aminobenzenesulfonamido)-4,6-dimethylpyrimidine
has related synonym: 2-(p-Aminobenzenesulfonamido)-4,6-dimethylpyrimidine
has related synonym: 2-Sulfanilamido-4,6-dimethylpyrimidine
has related synonym: 4,6-Dimethyl-2-sulfanilamidopyrimidine
has related synonym: 4-Amino-N-(2,6-dimethyl-4-pyrimidinyl)benzenesulfonamide
has related synonym: 4-Amino-N-(4,6-dimethyl-pyrimidin-2-yl)-benzenesulfonamide
has related synonym: 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
has related synonym: 6-(4'-Aminobenzol-sulfonamido)-2,4-dimethylpyrimidin
has related synonym: N(1)-(4,6-Dimethyl-2-pyrimidinyl)sulfanilamide
has related synonym: N(1)-(4,6-Dimethyl-2-pyrimidyl)sulfanilamide
has related synonym: N-(4,6-Dimethyl-2-pyrimidyl)sulfanilamide
has related synonym: SMZ
has related synonym: Sulfadimethyldiazine
has related synonym: Sulfadimethylpyrimidine
has related synonym: Sulfametazina
has related synonym: Sulfametazyny
has related synonym: Sulfamezathine
has related synonym: Sulphadimethylpyrimidine
has related synonym: Sulphamethazine
has related synonym: sulfadimidina
has related synonym: sulfadimidine
has related synonym: sulfadimidinum
has related synonym: sulfamethazone
id: CHEBI:102265
in subset: 3 STAR

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: Beilstein:261304
source: Beilstein

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: CAS:57-68-1
source: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: CAS:57-68-1
source: KEGG COMPOUND

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: CAS:57-68-1
source: NIST Chemistry WebBook

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: Drug_Central:2502
source: DrugCentral

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: Gmelin:1009759
source: Gmelin

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:11431418
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:14552772
source: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:15603963
source: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:17311370
source: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:17596632
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:20028131
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:22903812
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23218311
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23384282
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23434485
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23454458
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23562141
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23636590
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23673752
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23673946
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:23704574
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:6864729
source: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:7021831
source: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:7328159
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:8199304
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: PMID:9886437
source: Europe PMC

Axiom
annotated source: sulfamethazine
annotated property: database_cross_reference
annotated target: Reaxys:261304
source: Reaxys

Axiom
annotated source: sulfamethazine
annotated property: has exact synonym
annotated target: 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: (p-Aminobenzolsulfonyl)-2-amino-4,6-dimethylpyrimidin
database_cross_reference: ChEBI

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 2-(4-Aminobenzenesulfonamido)-4,6-dimethylpyrimidine
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 2-(p-Aminobenzenesulfonamido)-4,6-dimethylpyrimidine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 2-Sulfanilamido-4,6-dimethylpyrimidine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 4,6-Dimethyl-2-sulfanilamidopyrimidine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 4-Amino-N-(2,6-dimethyl-4-pyrimidinyl)benzenesulfonamide
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 4-Amino-N-(4,6-dimethyl-pyrimidin-2-yl)-benzenesulfonamide
database_cross_reference: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
database_cross_reference: ChEMBL

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: 6-(4'-Aminobenzol-sulfonamido)-2,4-dimethylpyrimidin
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: N(1)-(4,6-Dimethyl-2-pyrimidinyl)sulfanilamide
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: N(1)-(4,6-Dimethyl-2-pyrimidyl)sulfanilamide
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: N-(4,6-Dimethyl-2-pyrimidyl)sulfanilamide
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: SMZ
database_cross_reference: ChEBI

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulfadimethyldiazine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulfadimethylpyrimidine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulfametazina
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulfametazyny
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulfamezathine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulphadimethylpyrimidine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: Sulphamethazine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: sulfadimidina
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: sulfadimidine
database_cross_reference: KEGG_DRUG
has synonym type: INN

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: sulfadimidinum
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: sulfamethazine
annotated property: hasRelatedSynonym
annotated target: sulfamethazone
database_cross_reference: ChEBI

1-naphthol
type: Class
subclass of: CHEBI_35682
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50902
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76967
definition: A naphthol carrying a hydroxy group at position 1.
charge: 0
formula: C10H8O
inchi: InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H
inchikey: KJCVRFUGPWSIIH-UHFFFAOYSA-N
mass: 144.16992
monoisotopicmass: 144.05751
smiles: Oc1cccc2ccccc12
database_cross_reference: Beilstein:1817321
database_cross_reference: CAS:90-15-3
database_cross_reference: Gmelin:69192
database_cross_reference: HMDB:HMDB0012138
database_cross_reference: KEGG:C11714
database_cross_reference: MetaCyc:NAPHTHOL
database_cross_reference: PDBeChem:1NP
database_cross_reference: PMID:16721410
database_cross_reference: PMID:18966375
database_cross_reference: PMID:22740618
database_cross_reference: Reaxys:1817321
database_cross_reference: Wikipedia:1-Naphthol
has exact synonym: 1-Naphthol
has exact synonym: 1-naphthol
has exact synonym: naphthalen-1-ol
has OBO namespace: chebi_ontology
has related synonym: 1-hydroxynaphthalene
has related synonym: 1-naphthalenol
has related synonym: alpha-Naphthol
has related synonym: alpha-hydroxynaphthalene
has related synonym: alpha-naphthol
id: CHEBI:10319
in subset: 3 STAR

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: Beilstein:1817321
source: Beilstein

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: CAS:90-15-3
source: ChemIDplus

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: CAS:90-15-3
source: KEGG COMPOUND

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: CAS:90-15-3
source: NIST Chemistry WebBook

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: Gmelin:69192
source: Gmelin

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: PMID:16721410
source: Europe PMC

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: PMID:18966375
source: Europe PMC

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: PMID:22740618
source: Europe PMC

Axiom
annotated source: 1-naphthol
annotated property: database_cross_reference
annotated target: Reaxys:1817321
source: Reaxys

Axiom
annotated source: 1-naphthol
annotated property: has exact synonym
annotated target: 1-Naphthol
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 1-naphthol
annotated property: has exact synonym
annotated target: 1-naphthol
database_cross_reference: UniProt

Axiom
annotated source: 1-naphthol
annotated property: has exact synonym
annotated target: naphthalen-1-ol
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 1-naphthol
annotated property: hasRelatedSynonym
annotated target: 1-hydroxynaphthalene
database_cross_reference: HMDB

Axiom
annotated source: 1-naphthol
annotated property: hasRelatedSynonym
annotated target: 1-naphthalenol
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 1-naphthol
annotated property: hasRelatedSynonym
annotated target: alpha-Naphthol
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 1-naphthol
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxynaphthalene
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 1-naphthol
annotated property: hasRelatedSynonym
annotated target: alpha-naphthol
database_cross_reference: NIST_Chemistry_WebBook

2-naphthol
type: Class
subclass of: CHEBI_35682
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35444
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48578
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50902
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76967
subclass of: Restriction
  on property: has role
  some values from: CHEBI_84087
definition: A naphthol carrying a hydroxy group at position 2.
charge: 0
formula: C10H8O
inchi: InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H
inchikey: JWAZRIHNYRIHIV-UHFFFAOYSA-N
mass: 144.173
monoisotopicmass: 144.05751
smiles: OC1=CC2=CC=CC=C2C=C1
database_cross_reference: Beilstein:742134
database_cross_reference: CAS:135-19-3
database_cross_reference: Drug_Central:3370
database_cross_reference: FooDB:FDB000877
database_cross_reference: Gmelin:27395
database_cross_reference: HMDB:HMDB0012322
database_cross_reference: KEGG:C11713
database_cross_reference: MetaCyc:CPD-8131
database_cross_reference: PDBeChem:03V
database_cross_reference: PMID:13386410
database_cross_reference: PMID:14751800
database_cross_reference: PMID:18515997
database_cross_reference: PMID:18856458
database_cross_reference: PMID:20260560
database_cross_reference: PMID:22069470
database_cross_reference: PMID:22740618
database_cross_reference: PMID:23344974
database_cross_reference: PMID:29987264
database_cross_reference: PMID:30572877
database_cross_reference: PMID:30828382
database_cross_reference: PMID:32206945
database_cross_reference: PMID:33862438
database_cross_reference: PMID:34033865
database_cross_reference: Reaxys:742134
database_cross_reference: Wikipedia:2-Naphthol
has exact synonym: 2-Naphthol
has exact synonym: 2-naphthol
has exact synonym: naphthalen-2-ol
has OBO namespace: chebi_ontology
has related synonym: 2-Naftol
has related synonym: 2-hydroxynaphthalene
has related synonym: 2-naftolo
has related synonym: 2-naphthalenol
has related synonym: 2-naphtol
has related synonym: Antioxygene BN
has related synonym: Azogen Developer A
has related synonym: C.I. Azoic Coupling Component 1
has related synonym: C.I. Developer 5
has related synonym: Developer A
has related synonym: Developer AMS
has related synonym: Developer BN
has related synonym: Isonaphthol
has related synonym: beta-Naftol
has related synonym: beta-Naphthol
has related synonym: beta-Naphtol
has related synonym: beta-hydroxynaphthalene
has related synonym: beta-naftolo
has related synonym: beta-naphthol
has related synonym: beta-naphthyl alcohol
has related synonym: beta-naphthyl hydroxide
id: CHEBI:10432
in subset: 3 STAR

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: Beilstein:742134
source: Beilstein

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: CAS:135-19-3
source: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: CAS:135-19-3
source: KEGG COMPOUND

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: CAS:135-19-3
source: NIST Chemistry WebBook

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: Drug_Central:3370
source: DrugCentral

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: Gmelin:27395
source: Gmelin

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:13386410
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:14751800
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:18515997
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:18856458
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:20260560
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:22069470
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:22740618
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:23344974
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:29987264
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:30572877
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:30828382
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:32206945
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:33862438
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: PMID:34033865
source: Europe PMC

Axiom
annotated source: 2-naphthol
annotated property: database_cross_reference
annotated target: Reaxys:742134
source: Reaxys

Axiom
annotated source: 2-naphthol
annotated property: has exact synonym
annotated target: 2-Naphthol
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-naphthol
annotated property: has exact synonym
annotated target: 2-naphthol
database_cross_reference: UniProt

Axiom
annotated source: 2-naphthol
annotated property: has exact synonym
annotated target: naphthalen-2-ol
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: 2-Naftol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: 2-hydroxynaphthalene
database_cross_reference: HMDB

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: 2-naftolo
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: 2-naphthalenol
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: 2-naphtol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Antioxygene BN
database_cross_reference: HMDB
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Azogen Developer A
database_cross_reference: HMDB
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: C.I. Azoic Coupling Component 1
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: C.I. Developer 5
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Developer A
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Developer AMS
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Developer BN
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: Isonaphthol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-Naftol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-Naphthol
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-Naphtol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-hydroxynaphthalene
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-hydroxynaphthalene
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-naftolo
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-naphthol
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-naphthyl alcohol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-naphthol
annotated property: hasRelatedSynonym
annotated target: beta-naphthyl hydroxide
database_cross_reference: ChemIDplus

electron
type: Class
subclass of: CHEBI_36338
definition: Elementary particle not affected by the strong force having a spin 1/2, a negative elementary charge and a rest mass of 0.000548579903(13) u, or 0.51099906(15) MeV.
charge: -1
mass: 0.000548579903
monoisotopicmass: 0.0
database_cross_reference: KEGG:C05359
database_cross_reference: PMID:21614077
database_cross_reference: Wikipedia:Electron
has exact synonym: electron
has OBO namespace: chebi_ontology
has related synonym: Elektron
has related synonym: beta
has related synonym: beta(-)
has related synonym: beta-particle
has related synonym: e
has related synonym: e(-)
has related synonym: e-
has related synonym: negatron
id: CHEBI:10545
in subset: 3 STAR

Axiom
annotated source: electron
annotated property: database_cross_reference
annotated target: PMID:21614077
source: Europe PMC

Europe PMC
type: Axiom
annotated source: electron
annotated property: database_cross_reference
annotated target: PMID:21614077

Axiom
annotated source: electron
annotated property: has exact synonym
annotated target: electron
database_cross_reference: ChEBI

Axiom
annotated source: electron
annotated property: has exact synonym
annotated target: electron
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: electron
annotated property: has exact synonym
annotated target: electron
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: Elektron
database_cross_reference: ChEBI

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: beta
database_cross_reference: IUPAC

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: beta(-)
database_cross_reference: ChEBI

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: beta-particle
database_cross_reference: IUPAC

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: e
database_cross_reference: IUPAC

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: e(-)
database_cross_reference: UniProt

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: e-
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: electron
annotated property: hasRelatedSynonym
annotated target: negatron
database_cross_reference: IUPAC

1-(3-chlorophenyl)piperazine
type: Class
subclass of: CHEBI_46848
subclass of: CHEBI_83403
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35941
subclass of: Restriction
  on property: has role
  some values from: CHEBI_49103
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: A N-arylpiperazine that is piperazine carrying a 3-chlorophenyl substituent at position 1. It is a metabolite of the antidepressant drug trazodone.
charge: 0
formula: C10H13ClN2
inchi: InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2
inchikey: VHFVKMTVMIZMIK-UHFFFAOYSA-N
mass: 196.67640
monoisotopicmass: 196.07673
smiles: Clc1cccc(c1)N1CCNCC1
database_cross_reference: Beilstein:8409
database_cross_reference: CAS:6640-24-0
database_cross_reference: HMDB:HMDB0061008
database_cross_reference: KEGG:C11738
database_cross_reference: LINCS:LSM-25627
database_cross_reference: PMID:11311791
database_cross_reference: PMID:18621591
database_cross_reference: PMID:23768699
database_cross_reference: PMID:24062697
database_cross_reference: PMID:6827905
database_cross_reference: Reaxys:8409
database_cross_reference: Wikipedia:Meta-Chlorophenylpiperazine
has exact synonym: 1-(3-Chlorophenyl)piperazine
has exact synonym: 1-(3-chlorophenyl)piperazine
has OBO namespace: chebi_ontology
has related synonym: (m-CPP)
has related synonym: m-Chlorophenylpiperazine
id: CHEBI:10588
in subset: 3 STAR

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: Beilstein:8409
source: Beilstein

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: CAS:6640-24-0
source: ChemIDplus

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: CAS:6640-24-0
source: KEGG COMPOUND

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: PMID:11311791
source: Europe PMC

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: PMID:18621591
source: Europe PMC

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: PMID:23768699
source: Europe PMC

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: PMID:24062697
source: Europe PMC

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: PMID:6827905
source: Europe PMC

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: database_cross_reference
annotated target: Reaxys:8409
source: Reaxys

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: has exact synonym
annotated target: 1-(3-Chlorophenyl)piperazine
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: has exact synonym
annotated target: 1-(3-chlorophenyl)piperazine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: hasRelatedSynonym
annotated target: (m-CPP)
database_cross_reference: HMDB

Axiom
annotated source: 1-(3-chlorophenyl)piperazine
annotated property: hasRelatedSynonym
annotated target: m-Chlorophenylpiperazine
database_cross_reference: KEGG_COMPOUND

m-toluic acid
type: Class
subclass of: CHEBI_25280
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76967
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_28795
definition: A methylbenzoic acid carrying a methyl substituent at position 3.
charge: 0
formula: C8H8O2
inchi: InChI=1S/C8H8O2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3,(H,9,10)
inchikey: GPSDUZXPYCFOSQ-UHFFFAOYSA-N
mass: 136.14790
monoisotopicmass: 136.05243
smiles: Cc1cccc(c1)C(O)=O
database_cross_reference: Beilstein:970526
database_cross_reference: CAS:99-04-7
database_cross_reference: KEGG:C07211
database_cross_reference: MetaCyc:CPD-8775
database_cross_reference: PMID:11339298
database_cross_reference: PMID:11470206
database_cross_reference: PMID:22251573
database_cross_reference: PMID:22451532
database_cross_reference: PMID:2489427
database_cross_reference: Reaxys:970526
database_cross_reference: Wikipedia:M-Toluic_acid
has exact synonym: 3-methylbenzoic acid
has exact synonym: m-Toluic Acid
has OBO namespace: chebi_ontology
has related synonym: 3-toluic acid
has related synonym: beta-Bethylbenzoic acid
has related synonym: beta-Methylbenzoic acid
has related synonym: m-Toluylic acid
has related synonym: meta-Toluic acid
id: CHEBI:10589
in subset: 3 STAR

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: Beilstein:970526
source: Beilstein

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: CAS:99-04-7
source: ChemIDplus

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: CAS:99-04-7
source: KEGG COMPOUND

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: PMID:11339298
source: Europe PMC

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: PMID:11470206
source: Europe PMC

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: PMID:22251573
source: Europe PMC

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: PMID:22451532
source: Europe PMC

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: PMID:2489427
source: Europe PMC

Axiom
annotated source: m-toluic acid
annotated property: database_cross_reference
annotated target: Reaxys:970526
source: Reaxys

Axiom
annotated source: m-toluic acid
annotated property: has exact synonym
annotated target: 3-methylbenzoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: m-toluic acid
annotated property: has exact synonym
annotated target: m-Toluic Acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: m-toluic acid
annotated property: hasRelatedSynonym
annotated target: 3-toluic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: m-toluic acid
annotated property: hasRelatedSynonym
annotated target: beta-Bethylbenzoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: m-toluic acid
annotated property: hasRelatedSynonym
annotated target: beta-Methylbenzoic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: m-toluic acid
annotated property: hasRelatedSynonym
annotated target: m-Toluylic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: m-toluic acid
annotated property: hasRelatedSynonym
annotated target: meta-Toluic acid
database_cross_reference: ChemIDplus

omega-hydroxy fatty acid
type: Class
subclass of: CHEBI_15734
subclass of: CHEBI_24654
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_76307
definition: Any member of the class of naturally-occurring straight-chain fatty acids n carbon atoms long with a carboxyl group at position 1 and a hydroxyl at position n (omega).
formula: CH2O3(CH2)n
database_cross_reference: KEGG:C03547
database_cross_reference: PMID:13771448
database_cross_reference: PMID:16660004
has exact synonym: omega-Hydroxy fatty acid
has OBO namespace: chebi_ontology
has related synonym: omega-hydroxy fatty acids
id: CHEBI:10615
in subset: 3 STAR

Axiom
annotated source: omega-hydroxy fatty acid
annotated property: database_cross_reference
annotated target: PMID:13771448
source: Europe PMC

Axiom
annotated source: omega-hydroxy fatty acid
annotated property: database_cross_reference
annotated target: PMID:16660004
source: Europe PMC

Axiom
annotated source: omega-hydroxy fatty acid
annotated property: has exact synonym
annotated target: omega-Hydroxy fatty acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: omega-hydroxy fatty acid
annotated property: hasRelatedSynonym
annotated target: omega-hydroxy fatty acids
database_cross_reference: ChEBI

scyllo-inositol
type: Class
subclass of: CHEBI_24848
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
charge: 0
formula: C6H12O6
inchi: InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3+,4+,5-,6-
inchikey: CDAISMWEOUEBRE-CDRYSYESSA-N
mass: 180.15588
monoisotopicmass: 180.06339
has alternative id: CHEBI:26614
database_cross_reference: Beilstein:2206312
database_cross_reference: CAS:488-59-5
database_cross_reference: Gmelin:561300
database_cross_reference: KEGG:C06153
database_cross_reference: PMID:24352657
database_cross_reference: Reaxys:2206312
has exact synonym: scyllo-Inositol
has exact synonym: scyllo-inositol
has OBO namespace: chebi_ontology
has related synonym: (1r,2r,3r,4r,5r,6r)-cyclohexane-1,2,3,4,5,6-hexol
has related synonym: 1,3,5/2,4,6-cyclohexanehexol
has related synonym: Cocositol
has related synonym: Quercinitol
has related synonym: Scyllitol
id: CHEBI:10642
in subset: 3 STAR

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: Beilstein:2206312
source: Beilstein

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: CAS:488-59-5
source: ChemIDplus

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: CAS:488-59-5
source: KEGG COMPOUND

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: CAS:488-59-5
source: NIST Chemistry WebBook

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: Gmelin:561300
source: Gmelin

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: PMID:24352657
source: Europe PMC

Axiom
annotated source: scyllo-inositol
annotated property: database_cross_reference
annotated target: Reaxys:2206312
source: Reaxys

Axiom
annotated source: scyllo-inositol
annotated property: has exact synonym
annotated target: scyllo-Inositol
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: scyllo-inositol
annotated property: has exact synonym
annotated target: scyllo-inositol
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: scyllo-inositol
annotated property: has exact synonym
annotated target: scyllo-inositol
database_cross_reference: UniProt

Axiom
annotated source: scyllo-inositol
annotated property: hasRelatedSynonym
annotated target: (1r,2r,3r,4r,5r,6r)-cyclohexane-1,2,3,4,5,6-hexol
database_cross_reference: IUPAC

Axiom
annotated source: scyllo-inositol
annotated property: hasRelatedSynonym
annotated target: 1,3,5/2,4,6-cyclohexanehexol
database_cross_reference: IUPAC

Axiom
annotated source: scyllo-inositol
annotated property: hasRelatedSynonym
annotated target: Cocositol
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: scyllo-inositol
annotated property: hasRelatedSynonym
annotated target: Quercinitol
database_cross_reference: ChemIDplus

Axiom
annotated source: scyllo-inositol
annotated property: hasRelatedSynonym
annotated target: Scyllitol
database_cross_reference: ChemIDplus

metoclopramide
type: Class
subclass of: CHEBI_22702
subclass of: CHEBI_48975
subclass of: CHEBI_50996
subclass of: CHEBI_83403
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48561
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50919
subclass of: Restriction
  on property: has role
  some values from: CHEBI_55324
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_61170
definition: A member of the class of benzamides resulting from the formal condensation of 4-amino-5-chloro-2-methoxybenzoic acid with the primary amino group of N,N-diethylethane-1,2-diamine.
charge: 0
formula: C14H22ClN3O2
inchi: InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)
inchikey: TTWJBBZEZQICBI-UHFFFAOYSA-N
mass: 299.79600
monoisotopicmass: 299.14005
smiles: CCN(CC)CCNC(=O)c1cc(Cl)c(N)cc1OC
has alternative id: CHEBI:6898
database_cross_reference: CAS:364-62-5
database_cross_reference: DrugBank:DB01233
database_cross_reference: Drug_Central:1782
database_cross_reference: HMDB:HMDB0015363
database_cross_reference: KEGG:C07868
database_cross_reference: KEGG:D00726
database_cross_reference: LINCS:LSM-3689
database_cross_reference: Patent:BE620543
database_cross_reference: Patent:US3177252
database_cross_reference: Reaxys:1884366
database_cross_reference: VSDB:1821
database_cross_reference: Wikipedia:Metoclopramide
has exact synonym: 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide
has OBO namespace: chebi_ontology
has related synonym: 2-methoxy-4-amino-5-chloro-N,N-(dimethylaminoethyl)benzamide
has related synonym: 2-methoxy-5-chloroprocainamide
has related synonym: 4-amino-5-chloro-2-methoxy-N-(beta-diethylaminoethyl)benzamide
has related synonym: 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide
has related synonym: 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide
has related synonym: Elieten
has related synonym: Reliveran
has related synonym: metoclopramida
has related synonym: metoclopramide
has related synonym: metoclopramidum
id: CHEBI:107736
in subset: 3 STAR

Axiom
annotated source: metoclopramide
annotated property: database_cross_reference
annotated target: CAS:364-62-5
source: ChemIDplus

Axiom
annotated source: metoclopramide
annotated property: database_cross_reference
annotated target: CAS:364-62-5
source: KEGG DRUG

Axiom
annotated source: metoclopramide
annotated property: database_cross_reference
annotated target: Drug_Central:1782
source: DrugCentral

Axiom
annotated source: metoclopramide
annotated property: database_cross_reference
annotated target: Reaxys:1884366
source: Reaxys

Axiom
annotated source: metoclopramide
annotated property: has exact synonym
annotated target: 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: 2-methoxy-4-amino-5-chloro-N,N-(dimethylaminoethyl)benzamide
database_cross_reference: ChemIDplus

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: 2-methoxy-5-chloroprocainamide
database_cross_reference: ChemIDplus

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: 4-amino-5-chloro-2-methoxy-N-(beta-diethylaminoethyl)benzamide
database_cross_reference: ChemIDplus

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-2-methoxybenzamide
database_cross_reference: ChEMBL

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: 4-amino-5-chloro-N-(2-(diethylamino)ethyl)-o-anisamide
database_cross_reference: ChemIDplus

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: Elieten
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: Reliveran
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: metoclopramida
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: metoclopramide
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: metoclopramide
annotated property: hasRelatedSynonym
annotated target: metoclopramidum
database_cross_reference: ChemIDplus
has synonym type: INN

sodium ascorbate
type: Class
subclass of: CHEBI_176783
subclass of: CHEBI_38700
subclass of: FOODON_03412972
definition: An organic sodium salt resulting from the replacement of the proton from the 3-hydroxy group of ascorbic acid by a sodium ion.
IAO_0000118: sodium ascorbate
IAO_0000412: chebi.owl
IAO_0000412: http://langual.org
database_cross_reference: Codex::301
database_cross_reference: Europe::301
database_cross_reference: http://www.langual.org/langual_thesaurus.asp
has synonym: sodium l-ascorbate
comment: LanguaL term definition: Food additive; technological purpose(s): antioxidant.

2-hydroxybenzothiazole
type: Class
subclass of: CHEBI_45993
definition: Benzothiazole substituted with a hydroxy group at the 2-position.
charge: 0
formula: C7H5NOS
inchi: InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
inchikey: YEDUAINPPJYDJZ-UHFFFAOYSA-N
mass: 151.18600
monoisotopicmass: 151.00918
smiles: Oc1nc2ccccc2s1
database_cross_reference: Beilstein:742522
database_cross_reference: CAS:934-34-9
database_cross_reference: PMID:15750776
database_cross_reference: PMID:18568896
database_cross_reference: PMID:23224221
database_cross_reference: PMID:9544213
database_cross_reference: Reaxys:742522
has exact synonym: 1,3-benzothiazol-2-ol
has OBO namespace: chebi_ontology
has related synonym: (2-mercatophenyl)carbamothioic acid gamma-lactone
has related synonym: 2(3H)-Benzothiazolone
has related synonym: 2-Benzothiazolol
has related synonym: 2-Benzothiazolone
has related synonym: 2-hydroxy-1,3-benzothiazole
has related synonym: 3H-Benzothiazol-2-one
has related synonym: HBT
has related synonym: HOBT
id: CHEBI:115196
in subset: 3 STAR

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: Beilstein:742522
source: Beilstein

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: CAS:934-34-9
source: ChemIDplus

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: CAS:934-34-9
source: NIST Chemistry WebBook

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: PMID:15750776
source: Europe PMC

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: PMID:18568896
source: Europe PMC

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: PMID:23224221
source: Europe PMC

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: PMID:9544213
source: ChEMBL

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: database_cross_reference
annotated target: Reaxys:742522
source: Reaxys

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: has exact synonym
annotated target: 1,3-benzothiazol-2-ol
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: (2-mercatophenyl)carbamothioic acid gamma-lactone
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: 2(3H)-Benzothiazolone
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: 2-Benzothiazolol
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: 2-Benzothiazolone
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: 2-hydroxy-1,3-benzothiazole
database_cross_reference: ChEBI

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: 3H-Benzothiazol-2-one
database_cross_reference: ChEMBL

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: HBT
database_cross_reference: ChEBI

Axiom
annotated source: 2-hydroxybenzothiazole
annotated property: hasRelatedSynonym
annotated target: HOBT
database_cross_reference: ChEBI

diuron
type: Class
subclass of: CHEBI_157693
subclass of: CHEBI_23697
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25355
subclass of: Restriction
  on property: has role
  some values from: CHEBI_26089
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: A member of the class of 3-(3,4-substituted-phenyl)-1,1-dimethylureas that is urea in which both of the hydrogens attached to one nitrogen are substituted by methyl groups, and one of the hydrogens attached to the other nitrogen is substituted by a 3,4-dichlorophenyl group.
charge: 0
formula: C9H10Cl2N2O
inchi: InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)
inchikey: XMTQQYYKAHVGBJ-UHFFFAOYSA-N
mass: 233.09500
monoisotopicmass: 232.01702
smiles: CN(C)C(=O)Nc1ccc(Cl)c(Cl)c1
database_cross_reference: CAS:330-54-1
database_cross_reference: KEGG:C18428
database_cross_reference: LINCS:LSM-25609
database_cross_reference: MetaCyc:CPD-16775
database_cross_reference: PMID:10866370
database_cross_reference: PMID:17142046
database_cross_reference: PMID:17449247
database_cross_reference: PMID:23081760
database_cross_reference: PMID:33400299
database_cross_reference: PPDB:260
database_cross_reference: Patent:CN103120180
database_cross_reference: Patent:CN103125511
database_cross_reference: Patent:US2768971
database_cross_reference: Pesticides:diuron
database_cross_reference: Reaxys:2215168
database_cross_reference: Wikipedia:Diuron
has exact synonym: 3-(3,4-dichlorophenyl)-1,1-dimethylurea
has exact synonym: diuron
has OBO namespace: chebi_ontology
has related synonym: 1,1-dimethyl-3-(3,4-dichlorophenyl)urea
has related synonym: 1-(3,4-dichlorophenyl)-3,3-dimethylurea
has related synonym: 1-(3,4-dichlorophenyl)-3,3-dimethyluree
has related synonym: 3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff
has related synonym: 3-(3,4-Dichloro-phenyl)-1,1-dimethyl-urea
has related synonym: DCMU
has related synonym: N'-(3,4-dichlorophenyl)-N,N-dimethylurea
has related synonym: N,N,-dimethyl-N'-(3,4-dichlorophenyl)urea
has related synonym: N-(3,4-dichlorophenyl)-N',N'-dimethylurea
id: CHEBI:116509
in subset: 3 STAR

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: CAS:330-54-1
source: ChemIDplus

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: CAS:330-54-1
source: KEGG COMPOUND

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: CAS:330-54-1
source: NIST Chemistry WebBook

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: PMID:10866370
source: ChEMBL

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: PMID:17142046
source: ChEMBL

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: PMID:17449247
source: ChEMBL

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: PMID:23081760
source: Europe PMC

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: PMID:33400299
source: Europe PMC

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: Pesticides:diuron
source: Alan Wood's Pesticides

Axiom
annotated source: diuron
annotated property: database_cross_reference
annotated target: Reaxys:2215168
source: Reaxys

Axiom
annotated source: diuron
annotated property: has exact synonym
annotated target: 3-(3,4-dichlorophenyl)-1,1-dimethylurea
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: diuron
annotated property: has exact synonym
annotated target: diuron
database_cross_reference: UniProt

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: 1,1-dimethyl-3-(3,4-dichlorophenyl)urea
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: 1-(3,4-dichlorophenyl)-3,3-dimethylurea
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: 1-(3,4-dichlorophenyl)-3,3-dimethyluree
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: 3-(3,4-Dichlor-phenyl)-1,1-dimethyl-harnstoff
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: 3-(3,4-Dichloro-phenyl)-1,1-dimethyl-urea
database_cross_reference: ChEMBL

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: DCMU
database_cross_reference: ChEBI

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: N'-(3,4-dichlorophenyl)-N,N-dimethylurea
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: N,N,-dimethyl-N'-(3,4-dichlorophenyl)urea
database_cross_reference: ChemIDplus

Axiom
annotated source: diuron
annotated property: hasRelatedSynonym
annotated target: N-(3,4-dichlorophenyl)-N',N'-dimethylurea
database_cross_reference: ChemIDplus

fentanyl
type: Class
subclass of: anilide
subclass of: CHEBI_26151
subclass of: CHEBI_29347
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35482
subclass of: Restriction
  on property: has role
  some values from: CHEBI_38877
subclass of: Restriction
  on property: has role
  some values from: CHEBI_55322
subclass of: Restriction
  on property: has role
  some values from: CHEBI_60807
definition: A monocarboxylic acid amide resulting from the formal condensation of the aryl amino group of N-phenyl-1-(2-phenylethyl)piperidin-4-amine with propanoic acid.
charge: 0
formula: C22H28N2O
inchi: InChI=1S/C22H28N2O/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3
inchikey: PJMPHNIQZUBGLI-UHFFFAOYSA-N
mass: 336.47050
monoisotopicmass: 336.22016
smiles: CCC(=O)N(C1CCN(CC1)CCc1ccccc1)c1ccccc1
has alternative id: CHEBI:310077
has alternative id: CHEBI:5012
database_cross_reference: CAS:437-38-7
database_cross_reference: DrugBank:DB00813
database_cross_reference: Drug_Central:1164
database_cross_reference: KEGG:D00320
database_cross_reference: PMID:10669565
database_cross_reference: PMID:10987438
database_cross_reference: PMID:11585443
database_cross_reference: PMID:14698188
database_cross_reference: PMID:16621415
database_cross_reference: PMID:18462178
database_cross_reference: PMID:18728103
database_cross_reference: PMID:30176422
database_cross_reference: PMID:30305277
database_cross_reference: Patent:FR1344366
database_cross_reference: Patent:US3164600
database_cross_reference: Reaxys:494484
database_cross_reference: VSDB:1864
database_cross_reference: Wikipedia:Fentanyl
has exact synonym: N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
has OBO namespace: chebi_ontology
has related synonym: 1-phenethyl-4-(N-phenylpropionamido)piperidine
has related synonym: 1-phenethyl-4-N-propionylanilinopiperidine
has related synonym: Duragesic
has related synonym: N-(1-phenethyl-4-piperidinyl)-N-phenylpropionamide
has related synonym: N-(1-phenethyl-4-piperidyl)propionanilide
has related synonym: N-(1-phenethyl-piperidin-4-yl)-N-phenyl-propionamide
has related synonym: N-(1-phenethylpiperidin-4-yl)-N-phenylpropionamide
has related synonym: N-phenethyl-4-(N-propionylanilino)piperidine
has related synonym: N-phenyl-N-(1-(2-phenylethyl)-4-piperidinyl)propanamide
has related synonym: fentanilo
has related synonym: fentanyl
has related synonym: fentanylum
has related synonym: phentanyl
id: CHEBI:119915
in subset: 3 STAR

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: CAS:437-38-7
source: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: CAS:437-38-7
source: KEGG DRUG

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: Drug_Central:1164
source: DrugCentral

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:10669565
source: ChEMBL

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:10987438
source: ChEMBL

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:11585443
source: ChEMBL

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:14698188
source: ChEMBL

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:16621415
source: Europe PMC

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:18462178
source: Europe PMC

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:18728103
source: Europe PMC

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:30176422
source: Europe PMC

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: PMID:30305277
source: Europe PMC

Axiom
annotated source: fentanyl
annotated property: database_cross_reference
annotated target: Reaxys:494484
source: Reaxys

Axiom
annotated source: fentanyl
annotated property: has exact synonym
annotated target: N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: 1-phenethyl-4-(N-phenylpropionamido)piperidine
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: 1-phenethyl-4-N-propionylanilinopiperidine
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: Duragesic
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-(1-phenethyl-4-piperidinyl)-N-phenylpropionamide
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-(1-phenethyl-4-piperidyl)propionanilide
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-(1-phenethyl-piperidin-4-yl)-N-phenyl-propionamide
database_cross_reference: ChEMBL

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-(1-phenethylpiperidin-4-yl)-N-phenylpropionamide
database_cross_reference: ChEMBL

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-phenethyl-4-(N-propionylanilino)piperidine
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: N-phenyl-N-(1-(2-phenylethyl)-4-piperidinyl)propanamide
database_cross_reference: ChemIDplus

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: fentanilo
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: fentanyl
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: fentanylum
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: fentanyl
annotated property: hasRelatedSynonym
annotated target: phentanyl
database_cross_reference: DrugBank

2-nitrofluorene
type: Class
subclass of: CHEBI_51132
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25435
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50903
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_28266
definition: A nitroarene that is fluorene substituted by a nitro group at position 2.
charge: 0
formula: C13H9NO2
inchi: InChI=1S/C13H9NO2/c15-14(16)11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2
inchikey: XFOHWECQTFIEIX-UHFFFAOYSA-N
mass: 211.21610
monoisotopicmass: 211.06333
smiles: [O-][N+](=O)c1ccc-2c(Cc3ccccc-23)c1
database_cross_reference: Beilstein:1877983
database_cross_reference: CAS:607-57-8
database_cross_reference: KEGG:C10923
database_cross_reference: LINCS:LSM-37230
database_cross_reference: PMID:10366768
database_cross_reference: PMID:23128813
database_cross_reference: Reaxys:1877983
database_cross_reference: Wikipedia:2-Nitrofluorene
has exact synonym: 2-Nitrofluorene
has exact synonym: 2-nitro-9H-fluorene
has OBO namespace: chebi_ontology
has related synonym: NF
has related synonym: Nitrofluorene
id: CHEBI:1224
in subset: 3 STAR

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: Beilstein:1877983
source: Beilstein

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: CAS:607-57-8
source: ChemIDplus

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: CAS:607-57-8
source: KEGG COMPOUND

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: CAS:607-57-8
source: NIST Chemistry WebBook

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: PMID:10366768
source: Europe PMC

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: PMID:23128813
source: Europe PMC

Axiom
annotated source: 2-nitrofluorene
annotated property: database_cross_reference
annotated target: Reaxys:1877983
source: Reaxys

Axiom
annotated source: 2-nitrofluorene
annotated property: has exact synonym
annotated target: 2-Nitrofluorene
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-nitrofluorene
annotated property: has exact synonym
annotated target: 2-nitro-9H-fluorene
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-nitrofluorene
annotated property: hasRelatedSynonym
annotated target: NF
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-nitrofluorene
annotated property: hasRelatedSynonym
annotated target: Nitrofluorene
database_cross_reference: ChemIDplus

atomoxetine
type: Class
subclass of: CHEBI_27024
subclass of: CHEBI_35618
subclass of: CHEBI_50995
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35469
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35640
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: A secondary amino compound having methyl and 3-(2-methylphenoxy)-3-phenylpropan-1-yl substituents.
charge: 0
formula: C17H21NO
inchi: InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1
inchikey: VHGCDTVCOLNTBX-QGZVFWFLSA-N
mass: 255.35470
monoisotopicmass: 255.16231
smiles: CNCC[C@@H](Oc1ccccc1C)c1ccccc1
database_cross_reference: Beilstein:4318684
database_cross_reference: CAS:83015-26-3
database_cross_reference: DrugBank:DB00289
database_cross_reference: Drug_Central:256
database_cross_reference: HMDB:HMDB0014434
database_cross_reference: KEGG:D07473
database_cross_reference: LINCS:LSM-2452
database_cross_reference: PMID:15338851
database_cross_reference: PMID:23048018
database_cross_reference: Reaxys:4318684
database_cross_reference: Wikipedia:Atomoxetine
has exact synonym: (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine
has OBO namespace: chebi_ontology
has related synonym: (-)-Tomoxetine
has related synonym: Tomoxetina
has related synonym: Tomoxetinum
has related synonym: atomoxetine
has related synonym: tomoxetine
id: CHEBI:127342
in subset: 3 STAR

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: Beilstein:4318684
source: Beilstein

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: CAS:83015-26-3
source: ChemIDplus

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: CAS:83015-26-3
source: KEGG DRUG

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: Drug_Central:256
source: DrugCentral

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: PMID:15338851
source: Europe PMC

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: PMID:23048018
source: Europe PMC

Axiom
annotated source: atomoxetine
annotated property: database_cross_reference
annotated target: Reaxys:4318684
source: Reaxys

Axiom
annotated source: atomoxetine
annotated property: has exact synonym
annotated target: (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: atomoxetine
annotated property: hasRelatedSynonym
annotated target: (-)-Tomoxetine
database_cross_reference: ChEBI

Axiom
annotated source: atomoxetine
annotated property: hasRelatedSynonym
annotated target: Tomoxetina
database_cross_reference: DrugBank

Axiom
annotated source: atomoxetine
annotated property: hasRelatedSynonym
annotated target: Tomoxetinum
database_cross_reference: DrugBank

Axiom
annotated source: atomoxetine
annotated property: hasRelatedSynonym
annotated target: atomoxetine
database_cross_reference: KEGG_DRUG
has synonym type: INN

Axiom
annotated source: atomoxetine
annotated property: hasRelatedSynonym
annotated target: tomoxetine
database_cross_reference: DrugBank
has synonym type: INN

vitamin A
type: Class
subclass of: vitamin (molecular entity)
subclass of: CHEBI_26537
subclass of: FOODON_03413751
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24020
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25212
definition: Any member of a group of fat-soluble retinoids produced via metabolism of provitamin A carotenoids that exhibit biological activity against vitamin A deficiency. Vitamin A is involved in immune function, vision, reproduction, and cellular communication.
IAO_0000118: vitamin a
IAO_0000412: cdno.owl
IAO_0000412: http://langual.org
database_cross_reference: MetaCyc:Vitamin-A
database_cross_reference: Wikipedia:Vitamin_A
database_cross_reference: http://www.langual.org/langual_thesaurus.asp
has OBO namespace: chebi_ontology
has related synonym: vitamin A vitamer
has related synonym: vitamin A vitamers
has related synonym: vitamin-A
has related synonym: vitamins A
id: CHEBI:12777
in subset: 3 STAR

Axiom
annotated source: vitamin A
annotated property: hasRelatedSynonym
annotated target: vitamin A vitamer
database_cross_reference: ChEBI

Axiom
annotated source: vitamin A
annotated property: hasRelatedSynonym
annotated target: vitamin A vitamers
database_cross_reference: ChEBI

Axiom
annotated source: vitamin A
annotated property: hasRelatedSynonym
annotated target: vitamin-A
database_cross_reference: ChEBI

Axiom
annotated source: vitamin A
annotated property: hasRelatedSynonym
annotated target: vitamins A
database_cross_reference: ChEBI

hexopyranosyl hexopyranoside
type: Class
subclass of: CHEBI_24407
definition: A disaccharide formed by a (1<->1)-glycosidic bond between two hexopyranose units.
has exact synonym: hexopyranosyl hexopyranoside
has OBO namespace: chebi_ontology
id: CHEBI:131401
in subset: 3 STAR

Axiom
annotated source: hexopyranosyl hexopyranoside
annotated property: has exact synonym
annotated target: hexopyranosyl hexopyranoside
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

steroid aldehyde
type: Class
subclass of: CHEBI_17478
subclass of: CHEBI_35341
definition: Any steroid substituted by a formyl group.
has OBO namespace: chebi_ontology
has related synonym: steroid aldehydes
id: CHEBI:131565
in subset: 3 STAR

Axiom
annotated source: steroid aldehyde
annotated property: hasRelatedSynonym
annotated target: steroid aldehydes
database_cross_reference: ChEBI

Mycoplasma genitalium metabolite
type: Class
subclass of: CHEBI_76969
definition: Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
has OBO namespace: chebi_ontology
has related synonym: Mycoplasma genitalium metabolites
id: CHEBI:131604
in subset: 3 STAR

Axiom
annotated source: Mycoplasma genitalium metabolite
annotated property: hasRelatedSynonym
annotated target: Mycoplasma genitalium metabolites
database_cross_reference: ChEBI

C27-steroid
type: Class
subclass of: CHEBI_35341
subclass of: Restriction
  on property: has parent hydride
  some values from: CHEBI_35516
definition: A steroid compound with a structure based on a 27-carbon (cholestane) skeleton.
has OBO namespace: chebi_ontology
has related synonym: C27-steroids
id: CHEBI:131619
in subset: 3 STAR

Axiom
annotated source: C27-steroid
annotated property: hasRelatedSynonym
annotated target: C27-steroids
database_cross_reference: ChEBI

C19-steroid
type: Class
subclass of: CHEBI_35341
subclass of: Restriction
  on property: has parent hydride
  some values from: CHEBI_35509
definition: A steroid compound with a structure based on a 19-carbon (androstane) skeleton.
has OBO namespace: chebi_ontology
has related synonym: C19-steroids
id: CHEBI:131621
in subset: 3 STAR

Axiom
annotated source: C19-steroid
annotated property: hasRelatedSynonym
annotated target: C19-steroids
database_cross_reference: ChEBI

EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
type: Class
subclass of: CHEBI_38234
definition: A DNA polymerase inhibitor that interferes with the action of a DNA-directed DNA polymerase (EC 2.7.7.7).
database_cross_reference: Wikipedia:DNA_polymerase
has OBO namespace: chebi_ontology
has related synonym: DNA duplicase inhibitor
has related synonym: DNA duplicase inhibitors
has related synonym: DNA nucleotidyltransferase (DNA-directed) inhibitor
has related synonym: DNA nucleotidyltransferase (DNA-directed) inhibitors
has related synonym: DNA nucleotidyltransferase inhibitor
has related synonym: DNA nucleotidyltransferase inhibitors
has related synonym: DNA polymerase I inhibitor
has related synonym: DNA polymerase I inhibitors
has related synonym: DNA polymerase II inhibitor
has related synonym: DNA polymerase II inhibitors
has related synonym: DNA polymerase III inhibitor
has related synonym: DNA polymerase III inhibitors
has related synonym: DNA polymerase alpha inhibitor
has related synonym: DNA polymerase alpha inhibitors
has related synonym: DNA polymerase beta inhibitor
has related synonym: DNA polymerase beta inhibitors
has related synonym: DNA polymerase gamma inhibitor
has related synonym: DNA polymerase gamma inhibitors
has related synonym: DNA polymerase inhibitor
has related synonym: DNA polymerase inhibitors
has related synonym: DNA replicase inhibitor
has related synonym: DNA replicase inhibitors
has related synonym: DNA-dependent DNA polymerase inhibitor
has related synonym: DNA-dependent DNA polymerase inhibitors
has related synonym: DNA-directed DNA polymerase (EC 2.7.7.7) inhibitor
has related synonym: DNA-directed DNA polymerase (EC 2.7.7.7) inhibitors
has related synonym: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitors
has related synonym: EC 2.7.7.7 inhibitor
has related synonym: EC 2.7.7.7 inhibitors
has related synonym: Klenow fragment inhibitor
has related synonym: Klenow fragment inhibitors
has related synonym: Taq DNA polymerase inhibitor
has related synonym: Taq DNA polymerase inhibitors
has related synonym: Taq Pol I inhibitor
has related synonym: Taq Pol I inhibitors
has related synonym: Tca DNA polymerase inhibitor
has related synonym: Tca DNA polymerase inhibitors
has related synonym: deoxynucleate polymerase inhibitor
has related synonym: deoxynucleate polymerase inhibitors
has related synonym: deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitor
has related synonym: deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitors
has related synonym: deoxyribonucleate nucleotidyltransferase inhibitor
has related synonym: deoxyribonucleate nucleotidyltransferase inhibitors
has related synonym: deoxyribonucleic acid duplicase inhibitor
has related synonym: deoxyribonucleic acid duplicase inhibitors
has related synonym: deoxyribonucleic acid polymerase inhibitor
has related synonym: deoxyribonucleic acid polymerase inhibitors
has related synonym: deoxyribonucleic duplicase inhibitor
has related synonym: deoxyribonucleic duplicase inhibitors
has related synonym: deoxyribonucleic polymerase I inhibitor
has related synonym: deoxyribonucleic polymerase I inhibitors
has related synonym: deoxyribonucleic polymerase inhibitor
has related synonym: deoxyribonucleic polymerase inhibitors
has related synonym: duplicase inhibitor
has related synonym: duplicase inhibitors
has related synonym: sequenase inhibitor
has related synonym: sequenase inhibitors
id: CHEBI:131699
in subset: 3 STAR

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA duplicase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA duplicase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA nucleotidyltransferase (DNA-directed) inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA nucleotidyltransferase (DNA-directed) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA nucleotidyltransferase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA nucleotidyltransferase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase I inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase I inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase II inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase II inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase III inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase III inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase alpha inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase alpha inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase beta inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase beta inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase gamma inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase gamma inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA replicase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA replicase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA-dependent DNA polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA-dependent DNA polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA-directed DNA polymerase (EC 2.7.7.7) inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: DNA-directed DNA polymerase (EC 2.7.7.7) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 2.7.7.7 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 2.7.7.7 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Klenow fragment inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Klenow fragment inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Taq DNA polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Taq DNA polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Taq Pol I inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Taq Pol I inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Tca DNA polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Tca DNA polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxynucleate polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxynucleate polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxynucleoside-triphosphate:DNA deoxynucleotidyltransferase (DNA-directed) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleate nucleotidyltransferase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleate nucleotidyltransferase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic acid duplicase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic acid duplicase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic acid polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic acid polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic duplicase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic duplicase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic polymerase I inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic polymerase I inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic polymerase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: deoxyribonucleic polymerase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: duplicase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: duplicase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: sequenase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor
annotated property: hasRelatedSynonym
annotated target: sequenase inhibitors
database_cross_reference: ChEBI

EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
type: Class
subclass of: CHEBI_76895
definition: A EC 3.6.3.* (acid anhydride hydrolase catalysing transmembrane movement of substances) inhibitor that interferes with the action of channel-conductance-controlling ATPase (EC 3.6.3.49, also known as cystic fibrosis conductance regulator, CFCR).
has alternative id: CHEBI:131771
database_cross_reference: Wikipedia:Cystic_fibrosis_transmembrane_conductance_regulator
has OBO namespace: chebi_ontology
has related synonym: ATP phosphohydrolase (channel-conductance-controlling) inhibitor
has related synonym: ATP phosphohydrolase (channel-conductance-controlling) inhibitors
has related synonym: CFTR inhibitor
has related synonym: CFTR inhibitors
has related synonym: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitors
has related synonym: EC 3.6.3.49 inhibitor
has related synonym: EC 3.6.3.49 inhibitors
has related synonym: channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitor
has related synonym: channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitors
has related synonym: channel-conductance-controlling ATPase inhibitor
has related synonym: channel-conductance-controlling ATPase inhibitors
has related synonym: cystic fibrosis conductance regulator inhibitor
has related synonym: cystic fibrosis conductance regulator inhibitors
has related synonym: cystic fibrosis transmembrane conductance regulator inhibitor
has related synonym: cystic fibrosis transmembrane conductance regulator inhibitors
has related synonym: cystic-fibrosis membrane-conductance-regulating protein inhibitor
has related synonym: cystic-fibrosis membrane-conductance-regulating protein inhibitors
id: CHEBI:131770
in subset: 3 STAR

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: ATP phosphohydrolase (channel-conductance-controlling) inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: ATP phosphohydrolase (channel-conductance-controlling) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: CFTR inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: CFTR inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.6.3.49 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.6.3.49 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: channel-conductance-controlling ATPase (EC 3.6.3.49) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: channel-conductance-controlling ATPase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: channel-conductance-controlling ATPase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic fibrosis conductance regulator inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic fibrosis conductance regulator inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic fibrosis transmembrane conductance regulator inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic fibrosis transmembrane conductance regulator inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic-fibrosis membrane-conductance-regulating protein inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
annotated property: hasRelatedSynonym
annotated target: cystic-fibrosis membrane-conductance-regulating protein inhibitors
database_cross_reference: ChEBI

sulfamate
type: Class
subclass of: CHEBI_33554
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_35719
definition: An organosulfonate oxoanion obtained by deprotonation of the N-sulfo group of any sulfamic acid; major species at pH 7.3.
charge: -1
formula: HNO3SR
mass: 95.079
monoisotopicmass: 94.96771
smiles: S([O-])(=O)(=O)N*
has OBO namespace: chebi_ontology
has related synonym: a sulfamate
id: CHEBI:131822
in subset: 3 STAR

Axiom
annotated source: sulfamate
annotated property: hasRelatedSynonym
annotated target: a sulfamate
database_cross_reference: UniProt

octadecanoid anion
type: Class
subclass of: CHEBI 2580
subclass of: CHEBI_57560
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_36326
definition: An unsaturated fatty acid anion obtained by the deprotonation of the carboxy group of any octadecanoid.
has OBO namespace: chebi_ontology
has related synonym: anionic octadecanoid
has related synonym: anionic octadecanoids
has related synonym: octadecanoid anions
id: CHEBI:131860
in subset: 3 STAR

Axiom
annotated source: octadecanoid anion
annotated property: hasRelatedSynonym
annotated target: anionic octadecanoid
database_cross_reference: ChEBI

Axiom
annotated source: octadecanoid anion
annotated property: hasRelatedSynonym
annotated target: anionic octadecanoids
database_cross_reference: ChEBI

Axiom
annotated source: octadecanoid anion
annotated property: hasRelatedSynonym
annotated target: octadecanoid anions
database_cross_reference: ChEBI

HPODE(1-)
type: Class
subclass of: octadecanoid anion
subclass of: hydroperoxy polyunsaturated fatty acid anion
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_36329
definition: An octadecanoid anion anion obtained by the deprotonation of the carboxy group of any hydroperoxyoctadecadienoic acid.
has OBO namespace: chebi_ontology
has related synonym: HPODE anion
has related synonym: HPODE anions
has related synonym: hydroperoxyoctadecadienoate
has related synonym: hydroperoxyoctadecadienoates
id: CHEBI:131862
in subset: 3 STAR

Axiom
annotated source: HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: HPODE anion
database_cross_reference: ChEBI

Axiom
annotated source: HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: HPODE anions
database_cross_reference: ChEBI

Axiom
annotated source: HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: hydroperoxyoctadecadienoate
database_cross_reference: ChEBI

Axiom
annotated source: HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: hydroperoxyoctadecadienoates
database_cross_reference: SUBMITTER

hydroxy polyunsaturated fatty acid anion
type: Class
subclass of: CHEBI_59835
subclass of: CHEBI_76567
subclass of: Restriction
  on property: is conjugate base of
  some values from: hydroxy polyunsaturated fatty acid
definition: Any polyunsaturated fatty acid anion carrying one or more hydroxy substituents.
charge: -1
formula: CHO3R
mass: 61.017
monoisotopicmass: 60.99257
smiles: O*C([O-])=O
has OBO namespace: chebi_ontology
has related synonym: a hydroxy polyunsaturated fatty acid
has related synonym: hydroxy PUFA
has related synonym: hydroxy polyunsaturated fatty acid anions
id: CHEBI:131871
in subset: 3 STAR

Axiom
annotated source: hydroxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: a hydroxy polyunsaturated fatty acid
database_cross_reference: UniProt

Axiom
annotated source: hydroxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: hydroxy PUFA
database_cross_reference: SUBMITTER

Axiom
annotated source: hydroxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: hydroxy polyunsaturated fatty acid anions
database_cross_reference: ChEBI

(R)-imazamox(1-)
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_83744
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-imazamox(1-)
definition: A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of (R)-imazamox.
charge: -1
formula: C15H18N3O4
inchi: InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)/p-1/t15-/m1/s1
inchikey: NUPJIGQFXCQJBK-OAHLLOKOSA-M
mass: 304.322
monoisotopicmass: 304.13028
smiles: C1(=NC=C(C=C1C(=O)[O-])COC)C2=NC([C@@](N2)(C)C(C)C)=O
has exact synonym: 2-[(4R)-4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl]-5-(methoxymethyl)nicotinate
has OBO namespace: chebi_ontology
has related synonym: 2-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-5-methoxymethylnicotinate
has related synonym: 5-(methoxymethyl)-2-[(4R)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylate
id: CHEBI:131899
in subset: 3 STAR

Axiom
annotated source: (R)-imazamox(1-)
annotated property: has exact synonym
annotated target: 2-[(4R)-4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl]-5-(methoxymethyl)nicotinate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R)-imazamox(1-)
annotated property: hasRelatedSynonym
annotated target: 2-[(4R)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-5-methoxymethylnicotinate
database_cross_reference: ChEBI

Axiom
annotated source: (R)-imazamox(1-)
annotated property: hasRelatedSynonym
annotated target: 5-(methoxymethyl)-2-[(4R)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylate
database_cross_reference: ChEBI

dicarboxylic acids and O-substituted derivatives
type: Class
subclass of: CHEBI_36586
definition: A class of carbonyl compound encompassing dicarboxylic acids and any derivatives obtained by substitution of either one or both of the carboxy hydrogens.
has OBO namespace: chebi_ontology
has related synonym: dicarboxylic acids and derivatives
id: CHEBI:131927
in subset: 3 STAR

Axiom
annotated source: dicarboxylic acids and O-substituted derivatives
annotated property: hasRelatedSynonym
annotated target: dicarboxylic acids and derivatives
database_cross_reference: ChEBI

thifensulfuron
type: Class
subclass of: CHEBI_26588
subclass of: CHEBI_48436
subclass of: CHEBI_76983
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24527
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33286
definition: An N-sulfonylurea in which the sulfur atom is attached to a 2-carboxythiophen-3-yl group and in which the non-sulfonated nitrogen is substituted by a 4-methoxy-6-methyl-1,3,5-triazin-2-yl group. The corresponding methyl ester, known as thifensulfuron-methyl, is used as a post-emergence herbicide for the control of grass and broad-leaved weeds.
charge: 0
formula: C11H11N5O6S2
inchi: InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)
inchikey: LOQQVLXUKHKNIA-UHFFFAOYSA-N
mass: 373.368
monoisotopicmass: 373.01508
database_cross_reference: AGR:IND21975725
database_cross_reference: AGR:IND21983041
database_cross_reference: AGR:IND21984069
database_cross_reference: AGR:IND23256565
database_cross_reference: AGR:IND44616493
database_cross_reference: AGR:IND88022327
database_cross_reference: AGR:IND89001613
database_cross_reference: AGR:IND91008589
database_cross_reference: CAS:79277-67-1
database_cross_reference: PPDB:972
database_cross_reference: Pesticides:thifensulfuron
has exact synonym: 3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid
has OBO namespace: chebi_ontology
has related synonym: 3-(4-methoxy-6-methyl-1,3,5-triazin-2-ylcarbamoylsulfamoyl)thiophene-2-carboxylic acid
has related synonym: thiameturon
has related synonym: thifensulfuron acid
id: CHEBI:132053
in subset: 3 STAR

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND21975725
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND21983041
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND21984069
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND23256565
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND44616493
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND88022327
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND89001613
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: AGR:IND91008589
source: Europe PMC

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: CAS:79277-67-1
source: Alan Wood's Pesticides

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: CAS:79277-67-1
source: ChemIDplus

Axiom
annotated source: thifensulfuron
annotated property: database_cross_reference
annotated target: Pesticides:thifensulfuron
source: Alan Wood's Pesticides

Axiom
annotated source: thifensulfuron
annotated property: has exact synonym
annotated target: 3-{[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]sulfamoyl}thiophene-2-carboxylic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: thifensulfuron
annotated property: hasRelatedSynonym
annotated target: 3-(4-methoxy-6-methyl-1,3,5-triazin-2-ylcarbamoylsulfamoyl)thiophene-2-carboxylic acid
database_cross_reference: Alan_Wood's_Pesticides

Axiom
annotated source: thifensulfuron
annotated property: hasRelatedSynonym
annotated target: thiameturon
database_cross_reference: Alan_Wood's_Pesticides

Axiom
annotated source: thifensulfuron
annotated property: hasRelatedSynonym
annotated target: thifensulfuron acid
database_cross_reference: ChEBI

1,4-benzoquinones
type: Class
subclass of: CHEBI_22729
subclass of: CHEBI_25830
definition: Any member of the class of benzoquinones that is 1,4-benzoquinone or its C-substituted derivatives.
IAO_0000412: chebi.owl
charge: 0
formula: C6O2R4
mass: 104.063
monoisotopicmass: 103.98983
smiles: O=C1C(*)=C(*)C(=O)C(*)=C1*
has OBO namespace: chebi_ontology
has related synonym: a quinone
has related synonym: p-benzoquinones
has related synonym: para-benzoquinones
id: CHEBI:132124
in subset: 3 STAR

Axiom
annotated source: 1,4-benzoquinones
annotated property: hasRelatedSynonym
annotated target: a quinone
database_cross_reference: UniProt

Axiom
annotated source: 1,4-benzoquinones
annotated property: hasRelatedSynonym
annotated target: p-benzoquinones
database_cross_reference: ChEBI

Axiom
annotated source: 1,4-benzoquinones
annotated property: hasRelatedSynonym
annotated target: para-benzoquinones
database_cross_reference: ChEBI

hydroxyquinone
type: Class
subclass of: CHEBI_33822
subclass of: CHEBI_36141
definition: Any quinone in which one or more of the carbons making up the quinone moiety is substituted by a hydroxy group.
has OBO namespace: chebi_ontology
has related synonym: hydroxyquinones
id: CHEBI:132130
in subset: 3 STAR

Axiom
annotated source: hydroxyquinone
annotated property: hasRelatedSynonym
annotated target: hydroxyquinones
database_cross_reference: ChEBI

1,4-naphthoquinones
type: Class
subclass of: CHEBI_25481
subclass of: CHEBI_25830
definition: A naphthoquinone in which the oxo groups of the quinone moiety are at positions 1 and 4 of the parent naphthalene ring.
IAO_0000412: cdno.owl
IAO_0000412: chebi.owl
has OBO namespace: chebi_ontology
id: CHEBI:132142
in subset: 3 STAR

hydroxynaphthoquinone
type: Class
subclass of: hydroxyquinone
subclass of: CHEBI_25481
definition: Any naphthoquinone in which the naphthaoquinone moiety is substituted by at least one hydroxy group.
database_cross_reference: Wikipedia:Hydroxynaphthoquinone
has OBO namespace: chebi_ontology
has related synonym: hydroxynaphthoquinones
id: CHEBI:132155
in subset: 3 STAR

Axiom
annotated source: hydroxynaphthoquinone
annotated property: hasRelatedSynonym
annotated target: hydroxynaphthoquinones
database_cross_reference: ChEBI

hydroxy-1,4-naphthoquinone
type: Class
subclass of: 1,4-naphthoquinones
subclass of: hydroxynaphthoquinone
definition: Any member of the class of 1,4-naphthoquinones in which the naphthoquinone moiety is substituted by at least one hydroxy group.
has OBO namespace: chebi_ontology
has related synonym: hydroxy-1,4-naphthoquinones
id: CHEBI:132157
in subset: 3 STAR

Axiom
annotated source: hydroxy-1,4-naphthoquinone
annotated property: hasRelatedSynonym
annotated target: hydroxy-1,4-naphthoquinones
database_cross_reference: ChEBI

diethylammonium
type: Class
subclass of: CHEBI_58855
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_85259
definition: A secondary aliphatic ammonium ion resulting from the protonation of the amino group of diethylamine.
charge: +1
formula: C4H12N
inchi: InChI=1S/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3/p+1
inchikey: HPNMFZURTQLUMO-UHFFFAOYSA-O
mass: 74.145
monoisotopicmass: 74.09643
smiles: CC[NH2+]CC
has exact synonym: N-ethylethanaminium
has OBO namespace: chebi_ontology
id: CHEBI:132181
in subset: 3 STAR

Axiom
annotated source: diethylammonium
annotated property: has exact synonym
annotated target: N-ethylethanaminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

1-phenylpropan-2-amine
type: Class
subclass of: CHEBI_32877
definition: A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl groups has been replaced by a phenyl group.
charge: 0
formula: C9H13N
inchi: InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
inchikey: KWTSXDURSIMDCE-UHFFFAOYSA-N
mass: 135.207
monoisotopicmass: 135.10480
smiles: C=1(C=CC=CC1)CC(C)N
has exact synonym: 1-phenylpropan-2-amine
has OBO namespace: chebi_ontology
id: CHEBI:132233
in subset: 3 STAR

Axiom
annotated source: 1-phenylpropan-2-amine
annotated property: has exact synonym
annotated target: 1-phenylpropan-2-amine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

phenylephrine(1+)
type: Class
subclass of: CHEBI_25697
subclass of: CHEBI_35274
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI 8093
definition: An organic cation obtained by protonation of the secondary amino function of phenylephrine.
charge: +1
formula: C9H14NO2
inchi: InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/p+1/t9-/m0/s1
inchikey: SONNWYBIRXJNDC-VIFPVBQESA-O
mass: 168.213
monoisotopicmass: 168.10191
smiles: C=1C(=CC=CC1[C@H](C[NH2+]C)O)O
has exact synonym: (2R)-2-hydroxy-2-(3-hydroxyphenyl)-N-methylethan-1-aminium
has OBO namespace: chebi_ontology
has related synonym: phenylephrine cation
id: CHEBI:132294
in subset: 3 STAR

Axiom
annotated source: phenylephrine(1+)
annotated property: has exact synonym
annotated target: (2R)-2-hydroxy-2-(3-hydroxyphenyl)-N-methylethan-1-aminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: phenylephrine(1+)
annotated property: hasRelatedSynonym
annotated target: phenylephrine cation
database_cross_reference: ChEBI

methamphetamine(1+)
type: Class
subclass of: secondary ammonium ion
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI 6809
definition: An organic cation obtained by protonation of the secondary amino function of methamphetamine.
charge: +1
formula: C10H16N
inchi: InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/p+1/t9-/m0/s1
inchikey: MYWUZJCMWCOHBA-VIFPVBQESA-O
mass: 150.241
monoisotopicmass: 150.12773
smiles: C=1(C[C@@H]([NH2+]C)C)C=CC=CC1
has exact synonym: (2S)-N-methyl-1-phenylpropan-2-aminium
has OBO namespace: chebi_ontology
has related synonym: methamphetamine cation
id: CHEBI:132297
in subset: 3 STAR

Axiom
annotated source: methamphetamine(1+)
annotated property: has exact synonym
annotated target: (2S)-N-methyl-1-phenylpropan-2-aminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: methamphetamine(1+)
annotated property: hasRelatedSynonym
annotated target: methamphetamine cation
database_cross_reference: ChEBI

perfluorobutanesulfonic acid
type: Class
subclass of: perfluoroalkanesulfonic acid
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35195
definition: A perfluoroalkanesulfonic acid that is butane-1-sulfonic acid in which all of the hydrogens of the butyl group have been replaced by fluorines.
charge: 0
formula: C4HF9O3S
inchi: InChI=1S/C4HF9O3S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H,14,15,16)
inchikey: JGTNAGYHADQMCM-UHFFFAOYSA-N
mass: 300.101
monoisotopicmass: 299.95027
database_cross_reference: CAS:375-73-5
database_cross_reference: PMID:16433328
database_cross_reference: PMID:17917760
database_cross_reference: PMID:19059455
database_cross_reference: PMID:19429410
database_cross_reference: PMID:20451658
database_cross_reference: PMID:23441933
database_cross_reference: PMID:24238775
database_cross_reference: PMID:25268321
database_cross_reference: PMID:26360456
database_cross_reference: PMID:26610298
database_cross_reference: PMID:26780052
database_cross_reference: PMID:26889942
database_cross_reference: Patent:WO2011093371
database_cross_reference: Reaxys:1813588
database_cross_reference: Wikipedia:Perfluorobutanesulfonic_acid
has exact synonym: nonafluorobutane-1-sulfonic acid
has OBO namespace: chebi_ontology
has related synonym: 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonic acid
has related synonym: 1-perfluorobutanesulfonic acid
has related synonym: FC-98
has related synonym: PFBS
has related synonym: nonafluoro-1-butanesulfonic acid
has related synonym: nonafluorobutanesulfonic acid
has related synonym: perfluorobutane-1-sulfonic acid
id: CHEBI:132446
in subset: 3 STAR

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: CAS:375-73-5
source: ChemIDplus

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:16433328
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:17917760
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:19059455
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:19429410
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:20451658
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:23441933
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:24238775
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:25268321
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:26360456
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:26610298
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:26780052
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:26889942
source: Europe PMC

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: database_cross_reference
annotated target: Reaxys:1813588
source: Reaxys

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: has exact synonym
annotated target: nonafluorobutane-1-sulfonic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: 1,1,2,2,3,3,4,4,4-nonafluoro-1-butanesulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: 1-perfluorobutanesulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: FC-98
database_cross_reference: ChEBI

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: PFBS
database_cross_reference: ChEBI

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: nonafluoro-1-butanesulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: nonafluorobutanesulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorobutanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluorobutane-1-sulfonic acid
database_cross_reference: ChEBI

perfluoroalkanesulfonic acid
type: Class
subclass of: perfluorinated compound
subclass of: CHEBI_33551
definition: An organosulfonic acid in which the sulfo group is directly attached to a perfluoroalkyl group.
has OBO namespace: chebi_ontology
has related synonym: perfluoroalkanesulfonic acids
has related synonym: perfluoroalkylsulfonic acid
has related synonym: perfluoroalkylsulfonic acids
id: CHEBI:132447
in subset: 3 STAR

Axiom
annotated source: perfluoroalkanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluoroalkanesulfonic acids
database_cross_reference: ChEBI

Axiom
annotated source: perfluoroalkanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluoroalkylsulfonic acid
database_cross_reference: ChEBI

Axiom
annotated source: perfluoroalkanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluoroalkylsulfonic acids
database_cross_reference: ChEBI

perfluorohexanesulfonic acid
type: Class
subclass of: perfluoroalkanesulfonic acid
definition: A perfluoroalkanesulfonic acid that is hexane-1-sulfonic acid in which all thirteen of the hydrogens that are attached to carbons have been replaced by fluorines.
charge: 0
formula: C6HF13O3S
inchi: InChI=1S/C6HF13O3S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22/h(H,20,21,22)
inchikey: QZHDEAJFRJCDMF-UHFFFAOYSA-N
mass: 400.116
monoisotopicmass: 399.94388
database_cross_reference: CAS:355-46-4
database_cross_reference: PMID:20471065
database_cross_reference: PMID:21346631
database_cross_reference: Reaxys:1813793
has exact synonym: tridecafluorohexane-1-sulfonic acid
has OBO namespace: chebi_ontology
has related synonym: 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonic acid
has related synonym: perfluorohexane sulfonic acid
has related synonym: perfluorohexane-1-sulfonic acid
id: CHEBI:132448
in subset: 3 STAR

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: database_cross_reference
annotated target: CAS:355-46-4
source: ChemIDplus

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:20471065
source: Europe PMC

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: database_cross_reference
annotated target: PMID:21346631
source: Europe PMC

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: database_cross_reference
annotated target: Reaxys:1813793
source: Reaxys

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: has exact synonym
annotated target: tridecafluorohexane-1-sulfonic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: 1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexane-1-sulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluorohexane sulfonic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorohexanesulfonic acid
annotated property: hasRelatedSynonym
annotated target: perfluorohexane-1-sulfonic acid
database_cross_reference: ChemIDplus

anilide
type: Class
subclass of: CHEBI_22712
subclass of: CHEBI_62733
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_17296
definition: Any aromatic amide obtained by acylation of aniline.
charge: 0
formula: C7H6NOR
mass: 120.12860
monoisotopicmass: 120.04494
smiles: [*]C(=O)Nc1ccccc1
database_cross_reference: KEGG:C01402
database_cross_reference: PMID:23535982
database_cross_reference: PMID:23968552
database_cross_reference: PMID:24273122
database_cross_reference: PMID:6205897
has OBO namespace: chebi_ontology
has related synonym: N-phenyl amide
has related synonym: N-phenyl amides
has related synonym: an anilide
id: CHEBI:13248
in subset: 3 STAR

Axiom
annotated source: anilide
annotated property: database_cross_reference
annotated target: PMID:23535982
source: Europe PMC

Axiom
annotated source: anilide
annotated property: database_cross_reference
annotated target: PMID:23968552
source: Europe PMC

Axiom
annotated source: anilide
annotated property: database_cross_reference
annotated target: PMID:24273122
source: Europe PMC

Axiom
annotated source: anilide
annotated property: database_cross_reference
annotated target: PMID:6205897
source: Europe PMC

Axiom
annotated source: anilide
annotated property: hasRelatedSynonym
annotated target: N-phenyl amide
database_cross_reference: ChEBI

Axiom
annotated source: anilide
annotated property: hasRelatedSynonym
annotated target: N-phenyl amides
database_cross_reference: ChEBI

Axiom
annotated source: anilide
annotated property: hasRelatedSynonym
annotated target: an anilide
database_cross_reference: UniProt

fatty acid 20:4
type: Class
subclass of: CHEBI_26208
definition: Any polyunsaturated fatty acid containing 20 carbons and 4 double bonds.
charge: 0
formula: C20H32O2
mass: 304.46690
monoisotopicmass: 304.24023
smiles: C(=O)(O)*
has OBO namespace: chebi_ontology
has related synonym: FA 20:4
has related synonym: free fatty acid 20:4
id: CHEBI:132539
in subset: 3 STAR

Axiom
annotated source: fatty acid 20:4
annotated property: hasRelatedSynonym
annotated target: FA 20:4
database_cross_reference: ChEBI

Axiom
annotated source: fatty acid 20:4
annotated property: hasRelatedSynonym
annotated target: free fatty acid 20:4
database_cross_reference: ChEBI

bleaching agent
type: Class
subclass of: CHEBI_33893
definition: A reagent that lightens or whitens a substrate through chemical reaction. Bleaching reactions usually involve oxidative or reductive processes that degrade colour systems. Bleaching can occur by destroying one or more of the double bonds in the conjugated chain, by cleaving the conjugated chain, or by oxidation of one of the other moieties in the conjugated chain. Their reactivity results in many bleaches having strong bactericidal, disinfecting, and sterilising properties.
database_cross_reference: Wikipedia:Bleach
has OBO namespace: chebi_ontology
id: CHEBI:132717
in subset: 3 STAR

lysophosphatidic acid
type: Class
subclass of: CHEBI_32957
definition: A member of the class of lysophosphatidic acids obtained by hydrolytic removal of one of the two acyl groups of any phosphatidic acid. A 'closed' class.
charge: 0
formula: C3H7O6PR2
mass: 170.058
monoisotopicmass: 169.99802
smiles: [C@](CO*)(O*)([H])COP(O)(=O)O
has OBO namespace: chebi_ontology
has related synonym: lysophosphatidic acids
id: CHEBI:132742
in subset: 3 STAR

Axiom
annotated source: lysophosphatidic acid
annotated property: hasRelatedSynonym
annotated target: lysophosphatidic acids
database_cross_reference: ChEBI

sulfapyridine
type: Class
subclass of: CHEBI_26421
subclass of: CHEBI_48975
subclass of: CHEBI_87228
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35441
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50177
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
subclass of: Restriction
  on property: has role
  some values from: CHEBI_88188
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_45373
definition: A sulfonamide consisting of pyridine with a 4-aminobenzenesulfonamido group at the 2-position.
charge: 0
formula: C11H11N3O2S
inchi: InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)
inchikey: GECHUMIMRBOMGK-UHFFFAOYSA-N
mass: 249.28900
monoisotopicmass: 249.05720
smiles: Nc1ccc(cc1)S(=O)(=O)Nc1ccccn1
database_cross_reference: Beilstein:222065
database_cross_reference: CAS:144-83-2
database_cross_reference: DrugBank:DB00891
database_cross_reference: Drug_Central:2524
database_cross_reference: Gmelin:219135
database_cross_reference: HMDB:HMDB0015028
database_cross_reference: KEGG:D02434
database_cross_reference: LINCS:LSM-5531
database_cross_reference: PMID:11431418
database_cross_reference: PMID:17964793
database_cross_reference: PMID:6136612
database_cross_reference: PMID:6993682
database_cross_reference: PMID:7021831
database_cross_reference: Patent:GB512145
database_cross_reference: Patent:US2275354
database_cross_reference: Reaxys:222065
database_cross_reference: VSDB:1922
database_cross_reference: Wikipedia:Sulfapyridine
has exact synonym: 4-amino-N-(pyridin-2-yl)benzenesulfonamide
has OBO namespace: chebi_ontology
has related synonym: 2-(p-Aminobenzenesulphonamido)pyridine
has related synonym: 2-Sulfanilamidopyridin
has related synonym: 2-Sulfanilamidopyridine
has related synonym: 2-Sulfanilylaminopyridine
has related synonym: 2-Sulfapyridine
has related synonym: 4-(2-Pyridinylsulfonyl)aniline
has related synonym: 4-Amino-N,2-pyridinylbenzenesulfonamide
has related synonym: 4-Amino-N-pyridin-2-yl-benzenesulfonamide
has related synonym: 4-[(2-Pyridylamino)sulfonyl]aniline
has related synonym: N(1)-2-Pyridylsulfanilamide
has related synonym: N(1)-Pyridylsulfanilamide
has related synonym: N-2-Pyridylsulfanilamide
has related synonym: Solfapiridina
has related synonym: Sulphapyridine
has related synonym: sulfapiridina
has related synonym: sulfapyridine
has related synonym: sulfapyridinum
id: CHEBI:132842
in subset: 3 STAR

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: Beilstein:222065
source: Beilstein

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: CAS:144-83-2
source: ChemIDplus

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: CAS:144-83-2
source: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: CAS:144-83-2
source: KEGG DRUG

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: Drug_Central:2524
source: DrugCentral

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: Gmelin:219135
source: Gmelin

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: PMID:11431418
source: Europe PMC

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: PMID:17964793
source: ChEMBL

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: PMID:6136612
source: ChEMBL

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: PMID:6993682
source: ChEMBL

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: PMID:7021831
source: ChEMBL

Axiom
annotated source: sulfapyridine
annotated property: database_cross_reference
annotated target: Reaxys:222065
source: Reaxys

Axiom
annotated source: sulfapyridine
annotated property: has exact synonym
annotated target: 4-amino-N-(pyridin-2-yl)benzenesulfonamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 2-(p-Aminobenzenesulphonamido)pyridine
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 2-Sulfanilamidopyridin
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 2-Sulfanilamidopyridine
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 2-Sulfanilylaminopyridine
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 2-Sulfapyridine
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 4-(2-Pyridinylsulfonyl)aniline
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 4-Amino-N,2-pyridinylbenzenesulfonamide
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 4-Amino-N-pyridin-2-yl-benzenesulfonamide
database_cross_reference: ChEMBL

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: 4-[(2-Pyridylamino)sulfonyl]aniline
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: N(1)-2-Pyridylsulfanilamide
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: N(1)-Pyridylsulfanilamide
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: N-2-Pyridylsulfanilamide
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: Solfapiridina
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: Sulphapyridine
database_cross_reference: DrugBank

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: sulfapiridina
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: sulfapyridine
database_cross_reference: KEGG_DRUG
has synonym type: INN

Axiom
annotated source: sulfapyridine
annotated property: hasRelatedSynonym
annotated target: sulfapyridinum
database_cross_reference: ChemIDplus
has synonym type: INN

ibuprofen(1-)
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI 5855
definition: A monocarboxylic acid anion that is the conjugate base of ibuprofen, obtained by deprotonation of the carboxy group; major species at pH 7.3.
charge: -1
formula: C13H17O2
inchi: InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/p-1
inchikey: HEFNNWSXXWATRW-UHFFFAOYSA-M
mass: 205.273
monoisotopicmass: 205.12340
smiles: C=1C=C(C=CC1C(C(=O)[O-])C)CC(C)C
database_cross_reference: Reaxys:4784081
has exact synonym: 2-[4-(2-methylpropyl)phenyl]propanoate
has OBO namespace: chebi_ontology
has related synonym: ibuprofen
has related synonym: ibuprofen anion
id: CHEBI:132922
in subset: 3 STAR

Axiom
annotated source: ibuprofen(1-)
annotated property: database_cross_reference
annotated target: Reaxys:4784081
source: Reaxys

Axiom
annotated source: ibuprofen(1-)
annotated property: has exact synonym
annotated target: 2-[4-(2-methylpropyl)phenyl]propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: ibuprofen(1-)
annotated property: hasRelatedSynonym
annotated target: ibuprofen
database_cross_reference: ChEBI

Axiom
annotated source: ibuprofen(1-)
annotated property: hasRelatedSynonym
annotated target: ibuprofen anion
database_cross_reference: ChEBI

disodium 5'-guanylate
type: Class
subclass of: CHEBI_38700
subclass of: Restriction
  on property: has part
  some values from: CHEBI_58115
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35617
definition: An organic sodium salt that is the disodium salt of GMP.
charge: 0
formula: C10H12N5Na2O8P
inchi: InChI=1S/C10H14N5O8P.2Na/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21;;/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18);;/q;2*+1/p-2/t3-,5-,6-,9-;;/m1../s1
inchikey: PVBRXXAAPNGWGE-LGVAUZIVSA-L
mass: 407.185
monoisotopicmass: 407.02189
database_cross_reference: CAS:5550-12-9
database_cross_reference: PMID:1851447
database_cross_reference: PMID:22391056
database_cross_reference: PMID:4601956
database_cross_reference: Wikipedia:Disodium_guanylate
has exact synonym: disodium 5'-O-phosphonatoguanosine
has OBO namespace: chebi_ontology
has related synonym: 5'-gmp disodium salt
has related synonym: 5-guanylic acid disodium salt
has related synonym: E627
has related synonym: GMP disodium salt
has related synonym: disodium 5'-GMP
has related synonym: disodium GMP
has related synonym: disodium guanosine 5'-monophosphate
has related synonym: disodium guanosine-5'-monophosphate
has related synonym: disodium guanylate
has related synonym: guanosine 5'-monophosphate disodium salt
has related synonym: guanosine 5'-phosphate disodium salt
has related synonym: sodium guanylate
id: CHEBI:132932
in subset: 3 STAR

Axiom
annotated source: disodium 5'-guanylate
annotated property: database_cross_reference
annotated target: CAS:5550-12-9
source: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: database_cross_reference
annotated target: PMID:1851447
source: Europe PMC

Axiom
annotated source: disodium 5'-guanylate
annotated property: database_cross_reference
annotated target: PMID:22391056
source: Europe PMC

Axiom
annotated source: disodium 5'-guanylate
annotated property: database_cross_reference
annotated target: PMID:4601956
source: Europe PMC

Axiom
annotated source: disodium 5'-guanylate
annotated property: has exact synonym
annotated target: disodium 5'-O-phosphonatoguanosine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: 5'-gmp disodium salt
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: 5-guanylic acid disodium salt
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: E627
database_cross_reference: ChEBI

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: GMP disodium salt
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: disodium 5'-GMP
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: disodium GMP
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: disodium guanosine 5'-monophosphate
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: disodium guanosine-5'-monophosphate
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: disodium guanylate
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: guanosine 5'-monophosphate disodium salt
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: guanosine 5'-phosphate disodium salt
database_cross_reference: ChemIDplus

Axiom
annotated source: disodium 5'-guanylate
annotated property: hasRelatedSynonym
annotated target: sodium guanylate
database_cross_reference: ChemIDplus

octadec-9-enoate
type: Class
subclass of: CHEBI_78049
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_36021
definition: An octadecenoate in which the double bond is at C-9.
charge: -1
formula: C18H33O2
inchi: InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/p-1
inchikey: ZQPPMHVWECSIRJ-UHFFFAOYSA-M
mass: 281.454
monoisotopicmass: 281.24860
smiles: C(=CCCCCCCCC)CCCCCCCC(=O)[O-]
has exact synonym: octadec-9-enoate
has OBO namespace: chebi_ontology
has related synonym: 9-octadecenoate
has related synonym: C18:1, n-9(1-)
has related synonym: Delta(9)-octadecenoate
id: CHEBI:132944
in subset: 3 STAR

Axiom
annotated source: octadec-9-enoate
annotated property: has exact synonym
annotated target: octadec-9-enoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: octadec-9-enoate
annotated property: hasRelatedSynonym
annotated target: 9-octadecenoate
database_cross_reference: ChEBI

Axiom
annotated source: octadec-9-enoate
annotated property: hasRelatedSynonym
annotated target: C18:1, n-9(1-)
database_cross_reference: ChEBI

Axiom
annotated source: octadec-9-enoate
annotated property: hasRelatedSynonym
annotated target: Delta(9)-octadecenoate
database_cross_reference: ChEBI

maleate
type: Class
subclass of: CHEBI_35693
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_18300
definition: A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of maleic acid.
has OBO namespace: chebi_ontology
has related synonym: maleate anion
has related synonym: maleate anions
has related synonym: maleates
has related synonym: maleic acid anion
has related synonym: maleic acid anions
id: CHEBI:132951
in subset: 3 STAR

Axiom
annotated source: maleate
annotated property: hasRelatedSynonym
annotated target: maleate anion
database_cross_reference: ChEBI

Axiom
annotated source: maleate
annotated property: hasRelatedSynonym
annotated target: maleate anions
database_cross_reference: ChEBI

Axiom
annotated source: maleate
annotated property: hasRelatedSynonym
annotated target: maleates
database_cross_reference: ChEBI

Axiom
annotated source: maleate
annotated property: hasRelatedSynonym
annotated target: maleic acid anion
database_cross_reference: ChEBI

Axiom
annotated source: maleate
annotated property: hasRelatedSynonym
annotated target: maleic acid anions
database_cross_reference: ChEBI

oxalate
type: Class
subclass of: CHEBI_35693
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_16995
definition: A dicarboxylic acid anion obtained by deprotonation of at least one of the carboxy groups of oxalic acid.
has OBO namespace: chebi_ontology
has related synonym: ethanedioic acid anion
has related synonym: ethanedioic acid anions
has related synonym: oxalate anion
has related synonym: oxalate anions
has related synonym: oxalates
has related synonym: oxalic acid anion
has related synonym: oxalic acid anions
id: CHEBI:132952
in subset: 3 STAR

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: ethanedioic acid anion
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: ethanedioic acid anions
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: oxalate anion
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: oxalate anions
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: oxalates
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: oxalic acid anion
database_cross_reference: ChEBI

Axiom
annotated source: oxalate
annotated property: hasRelatedSynonym
annotated target: oxalic acid anions
database_cross_reference: ChEBI

butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
type: Class
subclass of: CHEBI_26421
subclass of: CHEBI_33308
subclass of: CHEBI_35618
subclass of: CHEBI_37143
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_28885
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_83598
definition: A carboxylic ester resulting from the formal condensation of the carboxy group 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoic acid with the hydroxy group of butan-1-ol.
charge: 0
formula: C19H20F3NO4
inchi: InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3
inchikey: VAIZTNZGPYBOGF-UHFFFAOYSA-N
mass: 383.362
monoisotopicmass: 383.13444
database_cross_reference: PPDB:323
has exact synonym: butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
has OBO namespace: chebi_ontology
id: CHEBI:132963
in subset: 3 STAR

Axiom
annotated source: butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
annotated property: has exact synonym
annotated target: butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

fluazifop-P-butyl
type: Class
subclass of: butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24527
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33286
subclass of: Restriction
  on property: has role
  some values from: CHEBI_70722
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_83599
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-fluazifop-butyl
definition: A butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate that has R configutation. The active enantiomer of the herbicide fluazifop-butyl, it is used as a post-emergence herbicide for the control grass weeds in various broad-leaved crops.
charge: 0
formula: C19H20F3NO4
inchi: InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m1/s1
inchikey: VAIZTNZGPYBOGF-CYBMUJFWSA-N
mass: 383.362
monoisotopicmass: 383.13444
database_cross_reference: AGR:IND601311742
database_cross_reference: CAS:79241-46-6
database_cross_reference: PMID:21487707
database_cross_reference: PMID:23387923
database_cross_reference: PMID:25149239
database_cross_reference: PMID:26147883
database_cross_reference: PMID:26628016
database_cross_reference: PMID:26735732
database_cross_reference: PMID:27157530
database_cross_reference: PMID:27378613
database_cross_reference: PPDB:324
database_cross_reference: Pesticides:fluazifop-p-butyl
database_cross_reference: Reaxys:8346184
has exact synonym: butyl (2R)-2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
has OBO namespace: chebi_ontology
has related synonym: Fusilade II
has related synonym: butyl (2R)-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoate
has related synonym: butyl (R)-2-{4-[5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionate
id: CHEBI:132964
in subset: 3 STAR

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: AGR:IND601311742
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: CAS:79241-46-6
source: Alan Wood's Pesticides

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: CAS:79241-46-6
source: ChemIDplus

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:21487707
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:23387923
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:25149239
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:26147883
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:26628016
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:26735732
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:27157530
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: PMID:27378613
source: Europe PMC

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: Pesticides:fluazifop-p-butyl
source: Alan Wood's Pesticides

Axiom
annotated source: fluazifop-P-butyl
annotated property: database_cross_reference
annotated target: Reaxys:8346184
source: Reaxys

Axiom
annotated source: fluazifop-P-butyl
annotated property: has exact synonym
annotated target: butyl (2R)-2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: fluazifop-P-butyl
annotated property: hasRelatedSynonym
annotated target: Fusilade II
database_cross_reference: ChEBI
has synonym type: BRAND NAME

Axiom
annotated source: fluazifop-P-butyl
annotated property: hasRelatedSynonym
annotated target: butyl (2R)-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoate
database_cross_reference: Alan_Wood's_Pesticides

Axiom
annotated source: fluazifop-P-butyl
annotated property: hasRelatedSynonym
annotated target: butyl (R)-2-{4-[5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionate
database_cross_reference: Alan_Wood's_Pesticides

(S)-fluazifop-butyl
type: Class
subclass of: butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
subclass of: Restriction
  on property: is enantiomer of
  some values from: fluazifop-P-butyl
definition: A butyl 2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate that has S configuration. It is the inactive enantiomer of the herbicide fluazifop-P-butyl.
charge: 0
formula: C19H20F3NO4
inchi: InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3/t13-/m0/s1
inchikey: VAIZTNZGPYBOGF-ZDUSSCGKSA-N
mass: 383.362
monoisotopicmass: 383.13444
database_cross_reference: PMID:21487707
database_cross_reference: PMID:26735732
has exact synonym: butyl (2S)-2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
has OBO namespace: chebi_ontology
has related synonym: butyl (2S)-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoate
has related synonym: butyl (S)-2-{4-[5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionate
id: CHEBI:132965
in subset: 3 STAR

Axiom
annotated source: (S)-fluazifop-butyl
annotated property: database_cross_reference
annotated target: PMID:21487707
source: Europe PMC

Axiom
annotated source: (S)-fluazifop-butyl
annotated property: database_cross_reference
annotated target: PMID:26735732
source: Europe PMC

Axiom
annotated source: (S)-fluazifop-butyl
annotated property: has exact synonym
annotated target: butyl (2S)-2-(4-{[5-(trifluoromethyl)pyridin-2-yl]oxy}phenoxy)propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-fluazifop-butyl
annotated property: hasRelatedSynonym
annotated target: butyl (2S)-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]oxy]phenoxy]propanoate
database_cross_reference: ChEBI

Axiom
annotated source: (S)-fluazifop-butyl
annotated property: hasRelatedSynonym
annotated target: butyl (S)-2-{4-[5-(trifluoromethyl)-2-pyridyloxy]phenoxy}propionate
database_cross_reference: ChEBI

radiosensitizing agent
type: Class
subclass of: CHEBI_23888
definition: A drug that makes increases the sensitivity of tumour cells to radiation therapy.
database_cross_reference: PMID:12520460
database_cross_reference: Wikipedia:Radiosensitizer
has OBO namespace: chebi_ontology
has related synonym: radiosensitiser
has related synonym: radiosensitisers
has related synonym: radiosensitising agent
has related synonym: radiosensitising agents
has related synonym: radiosensitizer
has related synonym: radiosensitizers
has related synonym: radiosensitizing agents
id: CHEBI:132992
in subset: 3 STAR

Axiom
annotated source: radiosensitizing agent
annotated property: database_cross_reference
annotated target: PMID:12520460
source: Europe PMC

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitiser
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitisers
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitising agent
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitising agents
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitizer
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitizers
database_cross_reference: ChEBI

Axiom
annotated source: radiosensitizing agent
annotated property: hasRelatedSynonym
annotated target: radiosensitizing agents
database_cross_reference: ChEBI

chromenochromene
type: Class
subclass of: CHEBI_38166
definition: Any organic heteroolycyclic compound whose skeleton two ortho-fused chromene rings, and their derivatives.
has OBO namespace: chebi_ontology
has related synonym: chromenochromenes
id: CHEBI:133135
in subset: 3 STAR

Axiom
annotated source: chromenochromene
annotated property: hasRelatedSynonym
annotated target: chromenochromenes
database_cross_reference: ChEBI

(S)-imazamox(1-)
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_83743
subclass of: Restriction
  on property: is enantiomer of
  some values from: (R)-imazamox(1-)
definition: A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of (S)-imazamox.
charge: -1
formula: C15H18N3O4
inchi: InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)/p-1/t15-/m0/s1
inchikey: NUPJIGQFXCQJBK-HNNXBMFYSA-M
mass: 304.322
monoisotopicmass: 304.13028
smiles: C1(=NC=C(C=C1C(=O)[O-])COC)C2=NC([C@](N2)(C)C(C)C)=O
has exact synonym: 2-[(4S)-4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl]-5-(methoxymethyl)nicotinate
has OBO namespace: chebi_ontology
has related synonym: (S)-imazamox anion
has related synonym: 2-[(4S)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-5-methoxymethylnicotinate
has related synonym: 5-(methoxymethyl)-2-[(4S)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylic acid
id: CHEBI:133193
in subset: 3 STAR

Axiom
annotated source: (S)-imazamox(1-)
annotated property: has exact synonym
annotated target: 2-[(4S)-4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl]-5-(methoxymethyl)nicotinate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-imazamox(1-)
annotated property: hasRelatedSynonym
annotated target: (S)-imazamox anion
database_cross_reference: ChEBI

Axiom
annotated source: (S)-imazamox(1-)
annotated property: hasRelatedSynonym
annotated target: 2-[(4S)-4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl]-5-methoxymethylnicotinate
database_cross_reference: ChEBI

Axiom
annotated source: (S)-imazamox(1-)
annotated property: hasRelatedSynonym
annotated target: 5-(methoxymethyl)-2-[(4S)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]pyridine-3-carboxylic acid
database_cross_reference: IUPAC

saturated fatty aldehyde
type: Class
subclass of: CHEBI_35746
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_26607
definition: A fatty aldehyde in which there is no carbon-carbon unsaturation.
charge: 0
formula: CHOR
mass: 29.018
monoisotopicmass: 29.00274
smiles: *C([H])=O
database_cross_reference: PMID:14564727
database_cross_reference: PMID:17805609
database_cross_reference: PMID:4531008
has OBO namespace: chebi_ontology
has related synonym: a saturated fatty aldehyde
has related synonym: saturated fatty aldehydes
id: CHEBI:133249
in subset: 3 STAR

Axiom
annotated source: saturated fatty aldehyde
annotated property: database_cross_reference
annotated target: PMID:14564727
source: Europe PMC

Axiom
annotated source: saturated fatty aldehyde
annotated property: database_cross_reference
annotated target: PMID:17805609
source: Europe PMC

Axiom
annotated source: saturated fatty aldehyde
annotated property: database_cross_reference
annotated target: PMID:4531008
source: Europe PMC

Axiom
annotated source: saturated fatty aldehyde
annotated property: hasRelatedSynonym
annotated target: a saturated fatty aldehyde
database_cross_reference: UniProt

Axiom
annotated source: saturated fatty aldehyde
annotated property: hasRelatedSynonym
annotated target: saturated fatty aldehydes
database_cross_reference: ChEBI

saturated dicarboxylic acid dianion(2-)
type: Class
subclass of: CHEBI_28965
definition: A carboxylic acid dianion obtained by deprotonation of both carboxy groups of any dicarboxylic acid that contains no carbon-carbon double bonds.
charge: -2
formula: C2O4R
mass: 88.019
monoisotopicmass: 87.97966
smiles: [O-]C(*C([O-])=O)=O
has OBO namespace: chebi_ontology
has related synonym: a saturated dicarboxylic acid
has related synonym: saturated dicarboxylate(2-)
id: CHEBI:133291
in subset: 3 STAR

Axiom
annotated source: saturated dicarboxylic acid dianion(2-)
annotated property: hasRelatedSynonym
annotated target: a saturated dicarboxylic acid
database_cross_reference: UniProt

Axiom
annotated source: saturated dicarboxylic acid dianion(2-)
annotated property: hasRelatedSynonym
annotated target: saturated dicarboxylate(2-)
database_cross_reference: SUBMITTER

metal oxide
type: Class
subclass of: CHEBI_24836
definition: An inorganic oxide that is an oxide of any metal.
has OBO namespace: chebi_ontology
has related synonym: metal oxides
id: CHEBI:133331
in subset: 3 STAR

Axiom
annotated source: metal oxide
annotated property: hasRelatedSynonym
annotated target: metal oxides
database_cross_reference: ChEBI

L-lysine zwitterion
type: Class
subclass of: CHEBI_59869
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_32551
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_18019
definition: An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of L-lysine; major species at pH 7.3.
charge: 0
formula: C6H14N2O2
inchi: InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1
inchikey: KDXKERNSBIXSRK-YFKPBYRVSA-N
mass: 146.188
monoisotopicmass: 146.10553
smiles: [O-]C([C@H](CCCCN)[NH3+])=O
has exact synonym: (2S)-6-amino-2-azaniumylhexanoate
has OBO namespace: chebi_ontology
has related synonym: L-lysine
has related synonym: Lys
has related synonym: lysine zwitterion
id: CHEBI:133538
in subset: 3 STAR

Axiom
annotated source: L-lysine zwitterion
annotated property: has exact synonym
annotated target: (2S)-6-amino-2-azaniumylhexanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: L-lysine zwitterion
annotated property: hasRelatedSynonym
annotated target: L-lysine
database_cross_reference: ChEBI

Axiom
annotated source: L-lysine zwitterion
annotated property: hasRelatedSynonym
annotated target: Lys
database_cross_reference: ChEBI

Axiom
annotated source: L-lysine zwitterion
annotated property: hasRelatedSynonym
annotated target: lysine zwitterion
database_cross_reference: ChEBI

glyphosate(1-)
type: Class
subclass of: CHEBI_58945
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_67052
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_27744
definition: An organophosphate oxoanion obtained by the deprotonation of the carboxy and one of the phosphate OH groups as well as protonation of the amino group of glyphosate. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
charge: -1
formula: C3H7NO5P
inchi: InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)/p-1
inchikey: XDDAORKBJWWYJS-UHFFFAOYSA-M
mass: 168.065
monoisotopicmass: 168.00673
smiles: O=C([O-])C[NH2+]CP(=O)(O)[O-]
has OBO namespace: chebi_ontology
has related synonym: glyphosate
id: CHEBI:133673
in subset: 3 STAR

Axiom
annotated source: glyphosate(1-)
annotated property: hasRelatedSynonym
annotated target: glyphosate
database_cross_reference: UniProt

primary nitroalkane
type: Class
subclass of: CHEBI 7587
definition: A nitroalkane in which the nitro group is attached to a terminal carbon. Major microspecies at pH 7.3.
charge: 0
formula: CH2NO2R
mass: 60.032
monoisotopicmass: 60.00855
smiles: C([N+]([O-])=O)*
database_cross_reference: MetaCyc:Nitroalkanes
database_cross_reference: PMID:1710166
database_cross_reference: PMID:26506056
database_cross_reference: PMID:7762004
has OBO namespace: chebi_ontology
has related synonym: a primary nitroalkane
id: CHEBI:133972
in subset: 3 STAR

Axiom
annotated source: primary nitroalkane
annotated property: database_cross_reference
annotated target: MetaCyc:Nitroalkanes
source: SUBMITTER

Axiom
annotated source: primary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:1710166
source: Europe PMC

Axiom
annotated source: primary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:26506056
source: Europe PMC

Axiom
annotated source: primary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:7762004
source: Europe PMC

Axiom
annotated source: primary nitroalkane
annotated property: hasRelatedSynonym
annotated target: a primary nitroalkane
database_cross_reference: UniProt

hydroperoxy polyunsaturated fatty acid anion
type: Class
subclass of: CHEBI_64012
subclass of: CHEBI_76567
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_189832
definition: Any polyunsaturated fatty acid anion carrying one or more hydroperoxy substituents.
charge: -1
formula: CHO4R
mass: 77.016
monoisotopicmass: 76.98748
smiles: *(C([O-])=O)OO
has OBO namespace: chebi_ontology
has related synonym: a hydroperoxy polyunsaturated fatty acid
has related synonym: hydroperoxy polyunsaturated fatty acid anions
has related synonym: hydroperoxy-polyunsaturated fatty acid anion
has related synonym: hydroperoxy-polyunsaturated fatty acid anions
id: CHEBI:134019
in subset: 3 STAR

Axiom
annotated source: hydroperoxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: a hydroperoxy polyunsaturated fatty acid
database_cross_reference: UniProt

Axiom
annotated source: hydroperoxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: hydroperoxy polyunsaturated fatty acid anions
database_cross_reference: ChEBI

Axiom
annotated source: hydroperoxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: hydroperoxy-polyunsaturated fatty acid anion
database_cross_reference: ChEBI

Axiom
annotated source: hydroperoxy polyunsaturated fatty acid anion
annotated property: hasRelatedSynonym
annotated target: hydroperoxy-polyunsaturated fatty acid anions
database_cross_reference: ChEBI

chlorofluorocarbon
type: Class
subclass of: volatile organic compound
subclass of: CHEBI_36683
subclass of: CHEBI_37143
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76413
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: An organochlorine compound derived from methane, ethane or propane that contains atoms of carbon, chlorine, and fluorine only. They are nontoxic, nonflammable chemicals used in aerosol sprays and as refrigerants. Being ozone depletion agents, their manufacture and use is being phased out under the Montreal Protocol.
database_cross_reference: Wikipedia:Chlorofluorocarbon
has OBO namespace: chebi_ontology
has related synonym: CFC
has related synonym: CFCs
has related synonym: chlorofluorocarbons
id: CHEBI:134024
in subset: 3 STAR

Axiom
annotated source: chlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: CFC
database_cross_reference: ChEBI

Axiom
annotated source: chlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: CFCs
database_cross_reference: ChEBI

Axiom
annotated source: chlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: chlorofluorocarbons
database_cross_reference: ChEBI

hydrochlorofluorocarbon
type: Class
subclass of: CHEBI_36683
subclass of: CHEBI_37143
definition: An organochlorine compound derived from methane, ethane or propane that contains atoms of hydrogen, chlorine, fluorine, and carbon only.
has OBO namespace: chebi_ontology
has related synonym: HCFC
has related synonym: HCFCs
has related synonym: hydro-chlorofluorocarbon
has related synonym: hydro-chlorofluorocarbons
has related synonym: hydrochlorofluorocarbons
id: CHEBI:134040
in subset: 3 STAR

Axiom
annotated source: hydrochlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: HCFC
database_cross_reference: ChEBI

Axiom
annotated source: hydrochlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: HCFCs
database_cross_reference: ChEBI

Axiom
annotated source: hydrochlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: hydro-chlorofluorocarbon
database_cross_reference: ChEBI

Axiom
annotated source: hydrochlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: hydro-chlorofluorocarbons
database_cross_reference: ChEBI

Axiom
annotated source: hydrochlorofluorocarbon
annotated property: hasRelatedSynonym
annotated target: hydrochlorofluorocarbons
database_cross_reference: ChEBI

phenylureas
type: Class
subclass of: CHEBI_22712
subclass of: CHEBI_47857
definition: Any member of the class of ureas in which at least one of the nitrogens of the urea moiety is substituted by a phenyl or substituted phenyl group.
has OBO namespace: chebi_ontology
id: CHEBI:134043
in subset: 3 STAR

1,4-dioxine
type: Class
subclass of: CHEBI_38104
definition: An oxacycle that is 4H-pyran in which the methylene group at position 4 is replaced by an oxygen. Non-aromatic.
charge: 0
formula: C4H4O2
inchi: InChI=1S/C4H4O2/c1-2-6-4-3-5-1/h1-4H
inchikey: KVGZZAHHUNAVKZ-UHFFFAOYSA-N
mass: 84.074
monoisotopicmass: 84.02113
smiles: C1=COC=CO1
database_cross_reference: CAS:290-67-5
database_cross_reference: Wikipedia:1,4-Dioxin
has exact synonym: 1,4-dioxine
has OBO namespace: chebi_ontology
has related synonym: 1,4-dioxin
has related synonym: dioxin
has related synonym: p-dioxin
id: CHEBI:134044
in subset: 3 STAR

Axiom
annotated source: 1,4-dioxine
annotated property: database_cross_reference
annotated target: CAS:290-67-5
source: ChemIDplus

Axiom
annotated source: 1,4-dioxine
annotated property: database_cross_reference
annotated target: CAS:290-67-5
source: NIST Chemistry WebBook

Axiom
annotated source: 1,4-dioxine
annotated property: has exact synonym
annotated target: 1,4-dioxine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 1,4-dioxine
annotated property: hasRelatedSynonym
annotated target: 1,4-dioxin
database_cross_reference: ChemIDplus

Axiom
annotated source: 1,4-dioxine
annotated property: hasRelatedSynonym
annotated target: dioxin
database_cross_reference: ChEBI

Axiom
annotated source: 1,4-dioxine
annotated property: hasRelatedSynonym
annotated target: p-dioxin
database_cross_reference: ChemIDplus

polychlorinated dibenzodioxines and related compounds
type: Class
subclass of: CHEBI_17792
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77853
definition: Organochlorine compounds that are polychlorinated dibenzodioxines and structurally related entities that are persistant organic pollutants. These include polychlorinated dibenzofurans as well as polychlorinated and polybrominated biphenyls They vary widely in their toxicity, but their toxic mode of action is through the aryl hydrocarbon receptor.
database_cross_reference: Wikipedia:Dioxins_and_dioxin-like_compounds
has OBO namespace: chebi_ontology
has related synonym: DLCs
has related synonym: PCDDs and related compounds
has related synonym: dioxins and dioxin-like compounds
has related synonym: polychlorinated dibenzodioxins and related compounds
id: CHEBI:134045
in subset: 3 STAR

Axiom
annotated source: polychlorinated dibenzodioxines and related compounds
annotated property: hasRelatedSynonym
annotated target: DLCs
database_cross_reference: ChEBI

Axiom
annotated source: polychlorinated dibenzodioxines and related compounds
annotated property: hasRelatedSynonym
annotated target: PCDDs and related compounds
database_cross_reference: ChEBI

Axiom
annotated source: polychlorinated dibenzodioxines and related compounds
annotated property: hasRelatedSynonym
annotated target: dioxins and dioxin-like compounds
database_cross_reference: ChEBI

Axiom
annotated source: polychlorinated dibenzodioxines and related compounds
annotated property: hasRelatedSynonym
annotated target: polychlorinated dibenzodioxins and related compounds
database_cross_reference: ChEBI

polychlorinated dibenzofuran
type: Class
subclass of: polychlorinated dibenzodioxines and related compounds
subclass of: CHEBI_36683
subclass of: CHEBI_38922
subclass of: Restriction
  on property: has role
  some values from: endocrine disruptor
definition: A member of the class of benzofurans that is benzofuran in which two or more of the hydrogens have reen replaced by chlorines.
database_cross_reference: PMID:24279584
database_cross_reference: PMID:25754105
database_cross_reference: PMID:27043380
database_cross_reference: PMID:27555483
database_cross_reference: PMID:27776226
database_cross_reference: PMID:27776233
database_cross_reference: Wikipedia:Polychlorinated_dibenzofurans
has OBO namespace: chebi_ontology
has related synonym: PCDF
has related synonym: PCDFs
has related synonym: polychlorinated dibenzofurans
id: CHEBI:134046
in subset: 3 STAR

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:24279584
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:25754105
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:27043380
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:27555483
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:27776226
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: database_cross_reference
annotated target: PMID:27776233
source: Europe PMC

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: hasRelatedSynonym
annotated target: PCDF
database_cross_reference: ChEBI

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: hasRelatedSynonym
annotated target: PCDFs
database_cross_reference: ChEBI

Axiom
annotated source: polychlorinated dibenzofuran
annotated property: hasRelatedSynonym
annotated target: polychlorinated dibenzofurans
database_cross_reference: ChEBI

bromobiphenyl
type: Class
subclass of: CHEBI_22888
subclass of: CHEBI_37148
subclass of: CHEBI_37149
definition: A bromoarene that consists of a biphenyl skeleton substituted by one or more bromo groups.
has OBO namespace: chebi_ontology
has related synonym: bromobiphenyls
id: CHEBI:134047
in subset: 3 STAR

Axiom
annotated source: bromobiphenyl
annotated property: hasRelatedSynonym
annotated target: bromobiphenyls
database_cross_reference: ChEBI

polybromobiphenyl
type: Class
subclass of: polychlorinated dibenzodioxines and related compounds
subclass of: bromobiphenyl
definition: A biphenyl compound containing between 2 and 10 bromine atoms attached to the two benzene rings.
database_cross_reference: Wikipedia:Polybrominated_biphenyl
has OBO namespace: chebi_ontology
has related synonym: PBB
has related synonym: PBBs
has related synonym: polybrominated biphenyl
has related synonym: polybrominated biphenyls
has related synonym: polybromobiphenyls
id: CHEBI:134049
in subset: 3 STAR

Axiom
annotated source: polybromobiphenyl
annotated property: hasRelatedSynonym
annotated target: PBB
database_cross_reference: ChEBI

Axiom
annotated source: polybromobiphenyl
annotated property: hasRelatedSynonym
annotated target: PBBs
database_cross_reference: ChEBI

Axiom
annotated source: polybromobiphenyl
annotated property: hasRelatedSynonym
annotated target: polybrominated biphenyl
database_cross_reference: ChEBI

Axiom
annotated source: polybromobiphenyl
annotated property: hasRelatedSynonym
annotated target: polybrominated biphenyls
database_cross_reference: ChEBI

Axiom
annotated source: polybromobiphenyl
annotated property: hasRelatedSynonym
annotated target: polybromobiphenyls
database_cross_reference: ChEBI

2,2',4,4',5,5'-hexabromobiphenyl
type: Class
subclass of: polybromobiphenyl
subclass of: CHEBI_172368
definition: A polybromobiphenyl that is biphenyl in which the hydrogens at positions 2, 2', 4, 4', 5, and 5' have been replace by bromines.
charge: 0
formula: C12H4Br6
inchi: InChI=1S/C12H4Br6/c13-7-3-11(17)9(15)1-5(7)6-2-10(16)12(18)4-8(6)14/h1-4H
inchikey: HMBBJSKXDBUNNT-UHFFFAOYSA-N
mass: 627.582
monoisotopicmass: 621.54133
database_cross_reference: CAS:59080-40-9
database_cross_reference: PMID:15099731
database_cross_reference: PMID:18255122
database_cross_reference: PMID:19034893
database_cross_reference: PMID:23721586
database_cross_reference: PMID:27474862
database_cross_reference: PMID:27521000
database_cross_reference: Reaxys:1991358
has exact synonym: 2,2',4,4',5,5'-hexabromo[biphenyl]
has OBO namespace: chebi_ontology
has related synonym: 2,2'4,4',5,5'-hexabromo-1,1'-biphenyl
has related synonym: 2,4,5,2',4',5'-hexabromobiphenyl
has related synonym: PBB 153
has related synonym: PBB-153
has related synonym: PBB153
id: CHEBI:134050
in subset: 3 STAR

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: CAS:59080-40-9
source: ChemIDplus

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: CAS:59080-40-9
source: NIST Chemistry WebBook

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:15099731
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:18255122
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:19034893
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:23721586
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:27474862
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: PMID:27521000
source: Europe PMC

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: database_cross_reference
annotated target: Reaxys:1991358
source: Reaxys

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: has exact synonym
annotated target: 2,2',4,4',5,5'-hexabromo[biphenyl]
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: hasRelatedSynonym
annotated target: 2,2'4,4',5,5'-hexabromo-1,1'-biphenyl
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: hasRelatedSynonym
annotated target: 2,4,5,2',4',5'-hexabromobiphenyl
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: hasRelatedSynonym
annotated target: PBB 153
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: hasRelatedSynonym
annotated target: PBB-153
database_cross_reference: ChEBI

Axiom
annotated source: 2,2',4,4',5,5'-hexabromobiphenyl
annotated property: hasRelatedSynonym
annotated target: PBB153
database_cross_reference: ChEBI

1,2,5,6,9,10-hexabromocyclododecane
type: Class
subclass of: CHEBI_172368
subclass of: CHEBI_22926
subclass of: CHEBI_22929
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50910
definition: A bromoalkane consisting of cyclododecane bearing six bromo substituents at positions 1, 2, 5, 6, 9 and 10.
charge: 0
formula: C12H18Br6
inchi: InChI=1S/C12H18Br6/c13-7-1-2-8(14)10(16)5-6-12(18)11(17)4-3-9(7)15/h7-12H,1-6H2
inchikey: DEIGXXQKDWULML-UHFFFAOYSA-N
mass: 641.693
monoisotopicmass: 635.65088
smiles: C1CC(C(CCC(C(CCC(C1Br)Br)Br)Br)Br)Br
database_cross_reference: CAS:3194-55-6
database_cross_reference: PMID:26184837
database_cross_reference: PMID:26629593
database_cross_reference: PMID:26633745
database_cross_reference: PMID:26718265
database_cross_reference: PMID:26739916
database_cross_reference: PMID:26786581
database_cross_reference: PMID:26810304
database_cross_reference: PMID:26824278
database_cross_reference: PMID:26876804
database_cross_reference: PMID:26924755
database_cross_reference: PMID:26929994
database_cross_reference: PMID:27262547
database_cross_reference: PMID:27401979
database_cross_reference: PMID:27414104
database_cross_reference: PMID:27434255
database_cross_reference: PMID:27494656
database_cross_reference: PMID:27542735
database_cross_reference: PMID:27579339
database_cross_reference: PMID:27694046
database_cross_reference: PMID:27717803
database_cross_reference: PMID:27741390
database_cross_reference: PMID:27745666
database_cross_reference: PMID:27814246
database_cross_reference: PMID:27830419
database_cross_reference: PMID:27915102
database_cross_reference: Reaxys:1911324
database_cross_reference: Wikipedia:Hexabromocyclododecane
has exact synonym: 1,2,5,6,9,10-hexabromocyclododecane
has OBO namespace: chebi_ontology
has related synonym: Cyclododecane, 1,2,5,6,9,10-hexabromo-
has related synonym: HBCD
has related synonym: Hexabromocyclododecane
id: CHEBI:134063
in subset: 3 STAR

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: CAS:3194-55-6
source: ChemIDplus

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26184837
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26629593
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26633745
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26718265
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26739916
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26786581
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26810304
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26824278
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26876804
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26924755
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:26929994
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27262547
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27401979
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27414104
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27434255
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27494656
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27542735
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27579339
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27694046
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27717803
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27741390
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27745666
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27814246
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27830419
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: PMID:27915102
source: Europe PMC

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: database_cross_reference
annotated target: Reaxys:1911324
source: Reaxys

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: has exact synonym
annotated target: 1,2,5,6,9,10-hexabromocyclododecane
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: hasRelatedSynonym
annotated target: Cyclododecane, 1,2,5,6,9,10-hexabromo-
database_cross_reference: SUBMITTER

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: hasRelatedSynonym
annotated target: HBCD
database_cross_reference: SUBMITTER

Axiom
annotated source: 1,2,5,6,9,10-hexabromocyclododecane
annotated property: hasRelatedSynonym
annotated target: Hexabromocyclododecane
database_cross_reference: SUBMITTER

copper oxide
type: Class
subclass of: metal oxide
subclass of: CHEBI_23377
definition: Any metal oxide in which the metallic component is copper.
has OBO namespace: chebi_ontology
has related synonym: copper oxides
id: CHEBI:134069
in subset: 3 STAR

Axiom
annotated source: copper oxide
annotated property: hasRelatedSynonym
annotated target: copper oxides
database_cross_reference: ChEBI

perfluorinated compound
type: Class
subclass of: CHEBI_37143
definition: An organofluorine compound containing only C-F bonds (no C-H bonds) and C-C bonds but also other heteroatoms (particularly other halogens, oxygen, and sulfur). Their properties represent a blend of fluorocarbons (containing only C-F and C-C bonds) and the parent functionalised organic species.
database_cross_reference: Wikipedia:Perfluorinated_compound
has OBO namespace: chebi_ontology
has related synonym: PFC
has related synonym: PFCs
has related synonym: perfluorinated compounds
id: CHEBI:134091
in subset: 3 STAR

Axiom
annotated source: perfluorinated compound
annotated property: hasRelatedSynonym
annotated target: PFC
database_cross_reference: ChEBI

Axiom
annotated source: perfluorinated compound
annotated property: hasRelatedSynonym
annotated target: PFCs
database_cross_reference: ChEBI

Axiom
annotated source: perfluorinated compound
annotated property: hasRelatedSynonym
annotated target: perfluorinated compounds
database_cross_reference: ChEBI

arsenocholine
type: Class
subclass of: CHEBI_33406
subclass of: CHEBI_62607
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76507
subclass of: Restriction
  on property: has role
  some values from: CHEBI_84087
definition: An arsonium ion that is choline in which the central nitrogen has been replaced by arsenic.
charge: +1
formula: C5H14AsO
inchi: InChI=1S/C5H14AsO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
inchikey: ORLOBEXOFQEWFQ-UHFFFAOYSA-N
mass: 165.086
monoisotopicmass: 165.02551
smiles: [As+](CCO)(C)(C)C
database_cross_reference: AGR:IND86035749
database_cross_reference: AGR:IND92025878
database_cross_reference: CAS:39895-81-3
database_cross_reference: HMDB:HMDB0032683
database_cross_reference: PMID:1580419
database_cross_reference: PMID:16746711
database_cross_reference: PMID:2363511
database_cross_reference: PMID:27277209
database_cross_reference: PMID:2953397
database_cross_reference: PMID:3288685
database_cross_reference: PMID:3349210
database_cross_reference: PMID:3435795
database_cross_reference: PMID:6642710
database_cross_reference: PMID:6719099
database_cross_reference: Reaxys:1736750
has exact synonym: (2-hydroxyethyl)(trimethyl)arsanium
has OBO namespace: chebi_ontology
has related synonym: (2-Hydroxyethyl)trimethylarsonium
id: CHEBI:134092
in subset: 3 STAR

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: AGR:IND86035749
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: AGR:IND92025878
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: CAS:39895-81-3
source: ChemIDplus

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:1580419
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:16746711
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:2363511
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:27277209
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:2953397
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:3288685
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:3349210
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:3435795
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:6642710
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: PMID:6719099
source: Europe PMC

Axiom
annotated source: arsenocholine
annotated property: database_cross_reference
annotated target: Reaxys:1736750
source: Reaxys

Axiom
annotated source: arsenocholine
annotated property: has exact synonym
annotated target: (2-hydroxyethyl)(trimethyl)arsanium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: arsenocholine
annotated property: hasRelatedSynonym
annotated target: (2-Hydroxyethyl)trimethylarsonium
database_cross_reference: ChemIDplus

polybromodiphenyl ether
type: Class
subclass of: CHEBI_172368
subclass of: CHEBI_35618
subclass of: CHEBI_37149
subclass of: Restriction
  on property: has role
  some values from: endocrine disruptor
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_39258
definition: An aromatic ether that is diphenyl ether carrying between 2 and 10 bromo substituents attached to the two benzene rings.
database_cross_reference: PMID:11482396
database_cross_reference: PMID:12850095
database_cross_reference: PMID:15568467
database_cross_reference: PMID:17638602
database_cross_reference: PMID:17904639
database_cross_reference: PMID:19100622
database_cross_reference: PMID:19260376
database_cross_reference: PMID:20100501
database_cross_reference: PMID:20557935
database_cross_reference: PMID:24270005
database_cross_reference: Wikipedia:Polybrominated_diphenyl_ethers
has OBO namespace: chebi_ontology
has related synonym: PBDE
has related synonym: polybrominated diphenyl ether
has related synonym: polybrominated diphenyl ethers
has related synonym: polybromodiphenyl ethers
id: CHEBI:134094
in subset: 3 STAR

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:11482396
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:12850095
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:15568467
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:17638602
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:17904639
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:19100622
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:19260376
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:20100501
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:20557935
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: database_cross_reference
annotated target: PMID:24270005
source: Europe PMC

Axiom
annotated source: polybromodiphenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE
database_cross_reference: ChEBI

Axiom
annotated source: polybromodiphenyl ether
annotated property: hasRelatedSynonym
annotated target: polybrominated diphenyl ether
database_cross_reference: ChEBI

Axiom
annotated source: polybromodiphenyl ether
annotated property: hasRelatedSynonym
annotated target: polybrominated diphenyl ethers
database_cross_reference: ChEBI

Axiom
annotated source: polybromodiphenyl ether
annotated property: hasRelatedSynonym
annotated target: polybromodiphenyl ethers
database_cross_reference: ChEBI

volatile organic compound
type: Class
subclass of: CHEBI_72695
definition: Any organic compound having an initial boiling point less than or equal to 250 degreeC (482 degreeF) measured at a standard atmospheric pressure of 101.3 kPa.
IAO_0000412: chebi.owl
database_cross_reference: Wikipedia:Volatile_organic_compound
has OBO namespace: chebi_ontology
has related synonym: VOC
has related synonym: VOCs
has related synonym: volatile organic compounds
id: CHEBI:134179
in subset: 3 STAR

Axiom
annotated source: volatile organic compound
annotated property: hasRelatedSynonym
annotated target: VOC
database_cross_reference: ChEBI

Axiom
annotated source: volatile organic compound
annotated property: hasRelatedSynonym
annotated target: VOCs
database_cross_reference: ChEBI

Axiom
annotated source: volatile organic compound
annotated property: hasRelatedSynonym
annotated target: volatile organic compounds
database_cross_reference: ChEBI

alkanesulfonate oxoanion
type: Class
subclass of: CHEBI_33554
definition: An alkanesulfonate in which the carbon at position 1 is attached to R, which can represent hydrogens, a carbon chain, or other groups.
charge: -1
formula: CH2O3SR
mass: 94.091
monoisotopicmass: 93.97246
smiles: C(S([O-])(=O)=O)*
has alternative id: CHEBI:22318
database_cross_reference: MetaCyc:Alkanesulfonates
has OBO namespace: chebi_ontology
has related synonym: alkanesulfonate oxoanions
has related synonym: alkanesulfonates
has related synonym: an alkanesulfonate
id: CHEBI:134249
in subset: 3 STAR

Axiom
annotated source: alkanesulfonate oxoanion
annotated property: hasRelatedSynonym
annotated target: alkanesulfonate oxoanions
database_cross_reference: ChEBI

Axiom
annotated source: alkanesulfonate oxoanion
annotated property: hasRelatedSynonym
annotated target: alkanesulfonates
database_cross_reference: ChEBI

Axiom
annotated source: alkanesulfonate oxoanion
annotated property: hasRelatedSynonym
annotated target: an alkanesulfonate
database_cross_reference: UniProt

guaiacols
type: Class
subclass of: CHEBI_25235
subclass of: CHEBI_33853
definition: Any phenol carrying an additional methoxy substituent at the ortho-position.
charge: 0
formula: C7H4O2R4
mass: 120.106
monoisotopicmass: 120.02113
smiles: C1(=C(C(=C(C(=C1*)*)*)OC)O)*
has alternative id: CHEBI:13645
database_cross_reference: MetaCyc:Guaiacols
has OBO namespace: chebi_ontology
has related synonym: 1-hydroxy-2-methoxybenzenes
has related synonym: 2-methoxyphenol
has related synonym: 2-methoxyphenol derivative
has related synonym: 2-methoxyphenol derivatives
has related synonym: 2-methoxyphenols
has related synonym: a guaiacol
has related synonym: catechol monomethyl ether
has related synonym: catechol monomethyl ethers
has related synonym: o-methoxyphenol
has related synonym: o-methoxyphenols
has related synonym: ortho-methoxyphenol
has related synonym: ortho-methoxyphenols
id: CHEBI:134251
in subset: 3 STAR

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: 1-hydroxy-2-methoxybenzenes
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: 2-methoxyphenol
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: 2-methoxyphenol derivative
database_cross_reference: SUBMITTER

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: 2-methoxyphenol derivatives
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: 2-methoxyphenols
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: a guaiacol
database_cross_reference: UniProt

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: catechol monomethyl ether
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: catechol monomethyl ethers
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: o-methoxyphenol
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: o-methoxyphenols
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: ortho-methoxyphenol
database_cross_reference: ChEBI

Axiom
annotated source: guaiacols
annotated property: hasRelatedSynonym
annotated target: ortho-methoxyphenols
database_cross_reference: ChEBI

allylic alcohol
type: Class
subclass of: CHEBI_30879
subclass of: CHEBI_78840
definition: An alcohol where the hydroxy group is attached to a saturated carbon atom adjacent to a double bond (R groups may be H, organyl, etc.).
charge: 0
formula: C3HOR5
mass: 53.040
monoisotopicmass: 53.00274
smiles: C(C(=C(*)*)*)(O)(*)*
has OBO namespace: chebi_ontology
has related synonym: allylic alcohols
id: CHEBI:134361
in subset: 3 STAR

Axiom
annotated source: allylic alcohol
annotated property: hasRelatedSynonym
annotated target: allylic alcohols
database_cross_reference: ChEBI

homoallylic alcohol
type: Class
subclass of: CHEBI 2571
subclass of: CHEBI_78840
definition: An aliphatic alcohol where the hydroxy carbon is beta to a double bond.
charge: 0
formula: C4HOR7
mass: 65.050
monoisotopicmass: 65.00274
smiles: C(=C(*)*)(C(C(O)(*)*)(*)*)*
has OBO namespace: chebi_ontology
has related synonym: homoallylic alcohols
id: CHEBI:134362
in subset: 3 STAR

Axiom
annotated source: homoallylic alcohol
annotated property: hasRelatedSynonym
annotated target: homoallylic alcohols
database_cross_reference: ChEBI

tertiary amine oxide
type: Class
subclass of: CHEBI_35580
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_50996
definition: An N-oxide where there are three organic groups bonded to the nitrogen atom.
charge: 0
formula: NOR3
mass: 30.006
monoisotopicmass: 29.99799
smiles: *[N+](*)([O-])*
database_cross_reference: Patent:EP0545208
database_cross_reference: Patent:EP0757983
database_cross_reference: Patent:EP0866058
database_cross_reference: Patent:EP1068179
database_cross_reference: Patent:US4206204
database_cross_reference: Patent:WO9950236
has OBO namespace: chebi_ontology
has related synonym: tertiary amine oxides
id: CHEBI:134363
in subset: 3 STAR

Axiom
annotated source: tertiary amine oxide
annotated property: hasRelatedSynonym
annotated target: tertiary amine oxides
database_cross_reference: ChEBI

primary allylic alcohol
type: Class
subclass of: allylic alcohol
subclass of: CHEBI_15734
definition: An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to two hydrogens.
charge: 0
formula: C3H3OR3
mass: 55.055
monoisotopicmass: 55.01839
smiles: C(C(=C(*)*)*)(O)([H])[H]
has OBO namespace: chebi_ontology
has related synonym: primary allylic alcohols
id: CHEBI:134394
in subset: 3 STAR

Axiom
annotated source: primary allylic alcohol
annotated property: hasRelatedSynonym
annotated target: primary allylic alcohols
database_cross_reference: ChEBI

secondary allylic alcohol
type: Class
subclass of: allylic alcohol
subclass of: CHEBI_35681
definition: An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to one other carbon and one hydrogen.
charge: 0
formula: C3H2OR4
mass: 54.047
monoisotopicmass: 54.01056
smiles: C(C(=C(*)*)*)(O)([H])*
has OBO namespace: chebi_ontology
has related synonym: secondary allylic alcohols
id: CHEBI:134396
in subset: 3 STAR

Axiom
annotated source: secondary allylic alcohol
annotated property: hasRelatedSynonym
annotated target: secondary allylic alcohols
database_cross_reference: ChEBI

tertiary allylic alcohol
type: Class
subclass of: allylic alcohol
subclass of: CHEBI_26878
definition: An allylic alcohol in which the carbon atom that links the double bond to the hydroxy group is also attached to two other carbons (R4,R5 =/= H).
charge: 0
formula: C3HOR5
mass: 53.040
monoisotopicmass: 53.00274
smiles: C(C(=C(*)*)*)(O)(*)*
has OBO namespace: chebi_ontology
has related synonym: tertiary allylic alcohols
id: CHEBI:134397
in subset: 3 STAR

Axiom
annotated source: tertiary allylic alcohol
annotated property: hasRelatedSynonym
annotated target: tertiary allylic alcohols
database_cross_reference: ChEBI

titanium oxides
type: Class
subclass of: CHEBI_37217
definition: A class containing any titanium molecular entity that is an oxide of titanium.
IAO_0000412: chebi.owl
has OBO namespace: chebi_ontology
has related synonym: titanium oxide
id: CHEBI:134438
in subset: 3 STAR

Axiom
annotated source: titanium oxides
annotated property: hasRelatedSynonym
annotated target: titanium oxide
database_cross_reference: ChEBI

titanium oxide nanoparticle
type: Class
subclass of: titanium oxides
subclass of: CHEBI_52855
definition: A nanoparticle composed of any titanium oxide.
has OBO namespace: chebi_ontology
id: CHEBI:134441
in subset: 3 STAR

naltrexone(1+)
type: Class
subclass of: CHEBI_25697
subclass of: CHEBI_35274
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI 7465
has OBO namespace: chebi_ontology
id: CHEBI:134688
in subset: 1 STAR

levomethadone
type: Class
subclass of: CHEBI_167309
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35482
subclass of: Restriction
  on property: has role
  some values from: CHEBI_51177
subclass of: Restriction
  on property: has role
  some values from: CHEBI_55322
subclass of: Restriction
  on property: has role
  some values from: CHEBI_60643
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_167308
definition: A 6-(dimethylamino)-4,4-diphenylheptan-3-one that has (R)-configuration. It is the active enantiomer of methadone and its hydrochloride salt is used to treat adults who are addicted to drugs such as heroin and morphine.
charge: 0
formula: C21H27NO
inchi: InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3/t17-/m1/s1
inchikey: USSIQXCVUWKGNF-QGZVFWFLSA-N
mass: 309.453
monoisotopicmass: 309.20926
database_cross_reference: CAS:125-58-6
database_cross_reference: Chemspider:20904
database_cross_reference: DrugBank:DB13515
database_cross_reference: Drug_Central:4586
database_cross_reference: KEGG:D08121
database_cross_reference: PMID:20308640
database_cross_reference: PMID:21371149
database_cross_reference: PMID:25669614
database_cross_reference: PMID:27974484
database_cross_reference: PMID:29393208
database_cross_reference: PMID:29902789
database_cross_reference: PMID:31842942
database_cross_reference: PMID:32302325
database_cross_reference: PMID:32586692
database_cross_reference: PMID:32903474
database_cross_reference: PMID:33345336
database_cross_reference: PMID:33423953
database_cross_reference: Reaxys:3213668
database_cross_reference: Wikipedia:Levomethadone
has exact synonym: (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one
has OBO namespace: chebi_ontology
has related synonym: (-)-(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone
has related synonym: (-)-methadone
has related synonym: (6R)-methadone
has related synonym: (R)-(-)-methadone
has related synonym: (R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone
has related synonym: (R)-methadone
has related synonym: L-6-(dimethylamino)-4,4-diphenyl-3-heptanone
has related synonym: R-methadone
has related synonym: l-methadone
has related synonym: levometadona
has related synonym: levomethadone
has related synonym: levomethadonum
id: CHEBI:136003
in subset: 3 STAR

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: CAS:125-58-6
source: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: Drug_Central:4586
source: DrugCentral

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:20308640
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:21371149
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:25669614
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:27974484
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:29393208
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:29902789
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:31842942
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:32302325
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:32586692
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:32903474
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:33345336
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: PMID:33423953
source: Europe PMC

Axiom
annotated source: levomethadone
annotated property: database_cross_reference
annotated target: Reaxys:3213668
source: Reaxys

Axiom
annotated source: levomethadone
annotated property: has exact synonym
annotated target: (6R)-6-(dimethylamino)-4,4-diphenylheptan-3-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (-)-(R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (-)-methadone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (6R)-methadone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (R)-(-)-methadone
database_cross_reference: ChEBI

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (R)-6-(dimethylamino)-4,4-diphenyl-3-heptanone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: (R)-methadone
database_cross_reference: ChEBI

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: L-6-(dimethylamino)-4,4-diphenyl-3-heptanone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: R-methadone
database_cross_reference: ChEBI

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: l-methadone
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: levometadona
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: levomethadone
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: levomethadone
annotated property: hasRelatedSynonym
annotated target: levomethadonum
database_cross_reference: WHO_MedNet
has synonym type: INN

jasmonic acid anion
type: Class
subclass of: CHEBI_35975
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24937
definition: A 5-oxo monocarboxylic acid anion obtained by deprotonation of the carboxy group of any diastereomer of jasmonic acid; major species at pH 7.3.
charge: -1
formula: C12H17O3
inchi: InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/p-1/b4-3-
inchikey: ZNJFBWYDHIGLCU-ARJAWSKDSA-M
mass: 209.262
monoisotopicmass: 209.11832
smiles: C1(C(CCC1=O)CC([O-])=O)C/C=C\CC
database_cross_reference: MetaCyc:Jasmonic-Acids
has exact synonym: {3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate
has OBO namespace: chebi_ontology
has related synonym: a jasmonate
has related synonym: jasmonate anion
id: CHEBI:136184
in subset: 3 STAR

Axiom
annotated source: jasmonic acid anion
annotated property: has exact synonym
annotated target: {3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: jasmonic acid anion
annotated property: hasRelatedSynonym
annotated target: a jasmonate
database_cross_reference: UniProt

Axiom
annotated source: jasmonic acid anion
annotated property: hasRelatedSynonym
annotated target: jasmonate anion
database_cross_reference: ChEBI

glycol
type: Class
subclass of: CHEBI_23824
definition: A diol in which the two hydroxy groups are on different carbon atoms, usually but not necessarily adjacent.
IAO_0000412: chebi.owl
has exact synonym: glycols
has OBO namespace: chebi_ontology
has related synonym: Glykol
id: CHEBI:13643
in subset: 3 STAR

Axiom
annotated source: glycol
annotated property: has exact synonym
annotated target: glycols
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: glycol
annotated property: hasRelatedSynonym
annotated target: Glykol
database_cross_reference: ChEBI

aci-nitro compound
type: Class
subclass of: CHEBI_35352
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_25750
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_35716
definition: Organonitrogen compounds that have the general structure R(1)(R(2))C=N(O)OH (R(1),R(2) = H, organyl). They are tautomers of C-nitro compounds.
charge: 0
formula: CHNO2R2
mass: 59.024
monoisotopicmass: 59.00073
smiles: C(*)(=[N+](O)[O-])*
has OBO namespace: chebi_ontology
has related synonym: aci-nitro compounds
has related synonym: oxime N-oxide
has related synonym: oxime N-oxides
id: CHEBI:136622
in subset: 3 STAR

Axiom
annotated source: aci-nitro compound
annotated property: hasRelatedSynonym
annotated target: aci-nitro compounds
database_cross_reference: ChEBI

Axiom
annotated source: aci-nitro compound
annotated property: hasRelatedSynonym
annotated target: oxime N-oxide
database_cross_reference: ChEBI

Axiom
annotated source: aci-nitro compound
annotated property: hasRelatedSynonym
annotated target: oxime N-oxides
database_cross_reference: ChEBI

propesticide
type: Class
subclass of: pro-agent
subclass of: CHEBI_25944
definition: A prodrug that, on administration, undergoes chemical conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the pharmacologically active pesticide for which it is a propesticide.
database_cross_reference: AGR:IND84086009
database_cross_reference: PMID:26449612
has OBO namespace: chebi_ontology
has related synonym: pro-pesticide
has related synonym: pro-pesticides
has related synonym: propesticides
id: CHEBI:136643
in subset: 3 STAR

Axiom
annotated source: propesticide
annotated property: database_cross_reference
annotated target: AGR:IND84086009
source: Europe PMC

Axiom
annotated source: propesticide
annotated property: database_cross_reference
annotated target: PMID:26449612
source: Europe PMC

Axiom
annotated source: propesticide
annotated property: hasRelatedSynonym
annotated target: pro-pesticide
database_cross_reference: ChEBI

Axiom
annotated source: propesticide
annotated property: hasRelatedSynonym
annotated target: pro-pesticides
database_cross_reference: ChEBI

Axiom
annotated source: propesticide
annotated property: hasRelatedSynonym
annotated target: propesticides
database_cross_reference: ChEBI

proinsecticide
type: Class
subclass of: propesticide
subclass of: CHEBI_24852
definition: A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active insecticide for which it is a proinsecticide.
database_cross_reference: AGR:IND20386178
database_cross_reference: AGR:IND84086011
database_cross_reference: AGR:IND89021681
database_cross_reference: AGR:IND92003154
database_cross_reference: PMID:16172027
database_cross_reference: PMID:26449612
database_cross_reference: PMID:27414472
database_cross_reference: PMID:27976502
has OBO namespace: chebi_ontology
has related synonym: pro-insecticide
has related synonym: pro-insecticides
has related synonym: proinsecticides
id: CHEBI:136644
in subset: 3 STAR

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: AGR:IND20386178
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: AGR:IND84086011
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: AGR:IND89021681
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: AGR:IND92003154
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: PMID:16172027
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: PMID:26449612
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: PMID:27414472
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: database_cross_reference
annotated target: PMID:27976502
source: Europe PMC

Axiom
annotated source: proinsecticide
annotated property: hasRelatedSynonym
annotated target: pro-insecticide
database_cross_reference: ChEBI

Axiom
annotated source: proinsecticide
annotated property: hasRelatedSynonym
annotated target: pro-insecticides
database_cross_reference: ChEBI

Axiom
annotated source: proinsecticide
annotated property: hasRelatedSynonym
annotated target: proinsecticides
database_cross_reference: ChEBI

proherbicide
type: Class
subclass of: propesticide
subclass of: CHEBI_24527
definition: A compound that, on administration, must undergo chemical conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the pharmacologically active herbicide for which it is a proherbicide.
database_cross_reference: AGR:IND43789627
database_cross_reference: PMID:12232216
database_cross_reference: PMID:26449612
database_cross_reference: PMID:27280658
has OBO namespace: chebi_ontology
has related synonym: pro-herbicide
has related synonym: pro-herbicides
has related synonym: proherbicides
id: CHEBI:136646
in subset: 3 STAR

Axiom
annotated source: proherbicide
annotated property: database_cross_reference
annotated target: AGR:IND43789627
source: Europe PMC

Axiom
annotated source: proherbicide
annotated property: database_cross_reference
annotated target: PMID:12232216
source: Europe PMC

Axiom
annotated source: proherbicide
annotated property: database_cross_reference
annotated target: PMID:26449612
source: Europe PMC

Axiom
annotated source: proherbicide
annotated property: database_cross_reference
annotated target: PMID:27280658
source: Europe PMC

Axiom
annotated source: proherbicide
annotated property: hasRelatedSynonym
annotated target: pro-herbicide
database_cross_reference: ChEBI

Axiom
annotated source: proherbicide
annotated property: hasRelatedSynonym
annotated target: pro-herbicides
database_cross_reference: ChEBI

Axiom
annotated source: proherbicide
annotated property: hasRelatedSynonym
annotated target: proherbicides
database_cross_reference: ChEBI

pyrazolooxadiazepine
type: Class
subclass of: CHEBI_27171
subclass of: CHEBI_38101
subclass of: CHEBI_38104
definition: An organic heterobicyclic compound whose skeleton consists of a pyrazole ring ortho-fused to a diazepine ring.
has OBO namespace: chebi_ontology
has related synonym: pyrazolooxadiazepin
has related synonym: pyrazolooxadiazepines
has related synonym: pyrazolooxadiazepins
id: CHEBI:136684
in subset: 3 STAR

Axiom
annotated source: pyrazolooxadiazepine
annotated property: hasRelatedSynonym
annotated target: pyrazolooxadiazepin
database_cross_reference: ChEBI

Axiom
annotated source: pyrazolooxadiazepine
annotated property: hasRelatedSynonym
annotated target: pyrazolooxadiazepines
database_cross_reference: ChEBI

Axiom
annotated source: pyrazolooxadiazepine
annotated property: hasRelatedSynonym
annotated target: pyrazolooxadiazepins
database_cross_reference: ChEBI

3,3',4,4'-tetrachlorobiphenyl
type: Class
subclass of: CHEBI_23697
subclass of: CHEBI_36720
definition: A tetrachlorobiphenyl that is biphenyl in which the hydrogens at position 3 and 4 on each phenyl group are replaced by chlorines.
charge: 0
formula: C12H6Cl4
inchi: InChI=1S/C12H6Cl4/c13-9-3-1-7(5-11(9)15)8-2-4-10(14)12(16)6-8/h1-6H
inchikey: UQMGJOKDKOLIDP-UHFFFAOYSA-N
mass: 291.98684
monoisotopicmass: 289.92236
smiles: Clc1ccc(cc1Cl)-c1ccc(Cl)c(Cl)c1
database_cross_reference: Beilstein:2051251
database_cross_reference: CAS:32598-13-3
database_cross_reference: KEGG:C11057
has exact synonym: 3,3',4,4'-tetrachloro-1,1'-biphenyl
has OBO namespace: chebi_ontology
has related synonym: 3,4,3',4'-Tetra coplanar polychlorinated biphenyl
has related synonym: 3,4,3',4'-Tetrachlorobiphenyl
has related synonym: PCB 77
id: CHEBI:1367
in subset: 3 STAR

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: database_cross_reference
annotated target: Beilstein:2051251
source: Beilstein

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: database_cross_reference
annotated target: CAS:32598-13-3
source: ChemIDplus

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: database_cross_reference
annotated target: CAS:32598-13-3
source: KEGG COMPOUND

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: database_cross_reference
annotated target: CAS:32598-13-3
source: NIST Chemistry WebBook

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: has exact synonym
annotated target: 3,3',4,4'-tetrachloro-1,1'-biphenyl
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: hasRelatedSynonym
annotated target: 3,4,3',4'-Tetra coplanar polychlorinated biphenyl
database_cross_reference: ChemIDplus

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: hasRelatedSynonym
annotated target: 3,4,3',4'-Tetrachlorobiphenyl
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 3,3',4,4'-tetrachlorobiphenyl
annotated property: hasRelatedSynonym
annotated target: PCB 77
database_cross_reference: KEGG_COMPOUND

ximelagatran (hydroxylamine form)
type: Class
subclass of: secondary carboxamide
subclass of: tertiary carboxamide
subclass of: CHEBI_23990
subclass of: CHEBI_24709
subclass of: CHEBI_38777
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_65172
definition: A member of the class of azetidines that is melagatran in which the carboxylic acid group has been converted into the corresponding ethyl ester and in which the amidine group has been converted to the corresponding hydroxylamine. Tautomeric with the oxime form of ximelagatran.
charge: 0
formula: C24H35N5O5
inchi: InChI=1S/C24H35N5O5/c1-2-34-20(30)15-26-21(17-6-4-3-5-7-17)24(32)29-13-12-19(29)23(31)27-14-16-8-10-18(11-9-16)22(25)28-33/h8-11,17,19,21,26,33H,2-7,12-15H2,1H3,(H2,25,28)(H,27,31)/t19-,21+/m0/s1
inchikey: ZXIBCJHYVWYIKI-PZJWPPBQSA-N
mass: 473.566
monoisotopicmass: 473.26382
database_cross_reference: PMID:28338626
database_cross_reference: Reaxys:9741940
has exact synonym: ethyl ({(1R)-1-cyclohexyl-2-[(2S)-2-({[4-(N-hydroxycarbamimidoyl)phenyl]methyl}carbamoyl)azetidin-1-yl]-2-oxoethyl}amino)acetate
has OBO namespace: chebi_ontology
id: CHEBI:136702
in subset: 3 STAR

Axiom
annotated source: ximelagatran (hydroxylamine form)
annotated property: database_cross_reference
annotated target: PMID:28338626
source: Europe PMC

Axiom
annotated source: ximelagatran (hydroxylamine form)
annotated property: database_cross_reference
annotated target: Reaxys:9741940
source: Reaxys

Axiom
annotated source: ximelagatran (hydroxylamine form)
annotated property: has exact synonym
annotated target: ethyl ({(1R)-1-cyclohexyl-2-[(2S)-2-({[4-(N-hydroxycarbamimidoyl)phenyl]methyl}carbamoyl)azetidin-1-yl]-2-oxoethyl}amino)acetate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

3-oxo-Delta(4)-steroid group
type: Class
subclass of: CHEBI_33247
definition: An organic group derived from any 3-oxo-Delta(4)-steroid.
charge: 0
formula: C6H6O
mass: 94.111
monoisotopicmass: 94.04186
smiles: C1=C(C*)*C(CC1=O)*
has OBO namespace: chebi_ontology
has related synonym: a 3-oxo-Delta4-steroid group
id: CHEBI:136849
in subset: 3 STAR

Axiom
annotated source: 3-oxo-Delta(4)-steroid group
annotated property: hasRelatedSynonym
annotated target: a 3-oxo-Delta4-steroid group
database_cross_reference: UniProt

pro-agent
type: Class
subclass of: CHEBI_33232
definition: A compound that, on administration, undergoes conversion by biochemical (enzymatic), chemical (possibly following an enzymatic step), or physical (e.g. photochemical) activation processes before becoming the active agent for which it is a pro-agent.
database_cross_reference: PMID:26449612
has OBO namespace: chebi_ontology
has related synonym: pro-agents
has related synonym: proagent
has related synonym: proagents
id: CHEBI:136859
in subset: 3 STAR

Axiom
annotated source: pro-agent
annotated property: database_cross_reference
annotated target: PMID:26449612
source: Europe PMC

Axiom
annotated source: pro-agent
annotated property: hasRelatedSynonym
annotated target: pro-agents
database_cross_reference: ChEBI

Axiom
annotated source: pro-agent
annotated property: hasRelatedSynonym
annotated target: proagent
database_cross_reference: ChEBI

Axiom
annotated source: pro-agent
annotated property: hasRelatedSynonym
annotated target: proagents
database_cross_reference: ChEBI

5beta steroid
type: Class
subclass of: CHEBI_35341
definition: Any steroid that has beta-configuration at position 5.
has OBO namespace: chebi_ontology
has related synonym: 5beta steroids
has related synonym: 5beta-steroid
has related synonym: 5beta-steroids
id: CHEBI:136889
in subset: 3 STAR

Axiom
annotated source: 5beta steroid
annotated property: hasRelatedSynonym
annotated target: 5beta steroids
database_cross_reference: ChEBI

Axiom
annotated source: 5beta steroid
annotated property: hasRelatedSynonym
annotated target: 5beta-steroid
database_cross_reference: ChEBI

Axiom
annotated source: 5beta steroid
annotated property: hasRelatedSynonym
annotated target: 5beta-steroids
database_cross_reference: ChEBI

acetylsalicylate
type: Class
subclass of: CHEBI_22718
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_30762
subclass of: Restriction
  on property: is conjugate base of
  some values from: acetylsalicylic acid
definition: A benzoate that is the conjugate base of acetylsalicylic acid, arising from deprotonation of the carboxy group.
charge: -1
formula: C9H7O4
inchi: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)/p-1
inchikey: BSYNRYMUTXBXSQ-UHFFFAOYSA-M
mass: 179.14948
monoisotopicmass: 179.03498
smiles: CC(=O)Oc1ccccc1C([O-])=O
database_cross_reference: Beilstein:3906821
database_cross_reference: HMDB:HMDB0001879
database_cross_reference: MetaCyc:CPD-524
database_cross_reference: Reaxys:3906821
has exact synonym: 2-(acetyloxy)benzoate
has exact synonym: acetylsalicylate
has OBO namespace: chebi_ontology
id: CHEBI:13719
in subset: 3 STAR

Axiom
annotated source: acetylsalicylate
annotated property: database_cross_reference
annotated target: Beilstein:3906821
source: Beilstein

Axiom
annotated source: acetylsalicylate
annotated property: database_cross_reference
annotated target: Reaxys:3906821
source: Reaxys

Axiom
annotated source: acetylsalicylate
annotated property: has exact synonym
annotated target: 2-(acetyloxy)benzoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetylsalicylate
annotated property: has exact synonym
annotated target: acetylsalicylate
database_cross_reference: UniProt

secondary ammonium ion
type: Class
subclass of: CHEBI_25697
subclass of: CHEBI_35274
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_32863
definition: An organic cation obtained by protonation of any secondary amino compound; major species at pH 7.3.
charge: +1
formula: H2NR2
mass: 16.023
monoisotopicmass: 16.01872
smiles: *[NH+](*)[H]
database_cross_reference: MetaCyc:Secondary-Amines
has OBO namespace: chebi_ontology
has related synonym: a secondary amine
has related synonym: secondary amine(1+)
id: CHEBI:137419
in subset: 3 STAR

Axiom
annotated source: secondary ammonium ion
annotated property: hasRelatedSynonym
annotated target: a secondary amine
database_cross_reference: UniProt

Axiom
annotated source: secondary ammonium ion
annotated property: hasRelatedSynonym
annotated target: secondary amine(1+)
database_cross_reference: ChEBI

quinoxaline herbicide
type: Class
subclass of: CHEBI_38821
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24527
definition: A quinoxaline pesticide that has herbicidal activity.
has OBO namespace: chebi_ontology
has related synonym: quinoxaline herbicides
id: CHEBI:137504
in subset: 3 STAR

Axiom
annotated source: quinoxaline herbicide
annotated property: hasRelatedSynonym
annotated target: quinoxaline herbicides
database_cross_reference: ChEBI

quizalofop-P
type: Class
subclass of: quinoxaline herbicide
subclass of: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
subclass of: Restriction
  on property: has role
  some values from: CHEBI_70722
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-quizalofop
definition: A 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid that has R configuration. An acetyl-CoA carboxylase inhibitor, it is used (generally as the corresponding ethyl or tefuryl ester proherbicides) for the control of annual and perennial grass weeds in sugar beet.
charge: 0
formula: C17H13ClN2O4
inchi: InChI=1S/C17H13ClN2O4/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-15-8-11(18)2-7-14(15)20-16/h2-10H,1H3,(H,21,22)/t10-/m1/s1
inchikey: ABOOPXYCKNFDNJ-SNVBAGLBSA-N
mass: 344.750
monoisotopicmass: 344.05638
database_cross_reference: CAS:94051-08-8
database_cross_reference: PMID:24964043
database_cross_reference: PMID:26971169
database_cross_reference: PMID:28692891
database_cross_reference: Pesticides:quizalofop-p
database_cross_reference: Reaxys:8395822
has exact synonym: (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
has OBO namespace: chebi_ontology
has related synonym: (+)-quizalofop
has related synonym: (+)-quizalofop-acid
has related synonym: (2R)-2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid
has related synonym: (R)-(+)-quizalofop
has related synonym: (R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionic acid
has related synonym: (R)-quizalofop
has related synonym: DPX-Y 6202-31
id: CHEBI:137507
in subset: 3 STAR

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: CAS:94051-08-8
source: Alan Wood's Pesticides

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: CAS:94051-08-8
source: ChemIDplus

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: PMID:24964043
source: Europe PMC

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: PMID:26971169
source: Europe PMC

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: PMID:28692891
source: Europe PMC

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: Pesticides:quizalofop-p
source: Alan Wood's Pesticides

Axiom
annotated source: quizalofop-P
annotated property: database_cross_reference
annotated target: Reaxys:8395822
source: Reaxys

Axiom
annotated source: quizalofop-P
annotated property: has exact synonym
annotated target: (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (+)-quizalofop
database_cross_reference: ChEBI

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (+)-quizalofop-acid
database_cross_reference: ChEBI

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (2R)-2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid
database_cross_reference: Alan_Wood's_Pesticides

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (R)-(+)-quizalofop
database_cross_reference: ChemIDplus

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionic acid
database_cross_reference: Alan_Wood's_Pesticides

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: (R)-quizalofop
database_cross_reference: ChEBI

Axiom
annotated source: quizalofop-P
annotated property: hasRelatedSynonym
annotated target: DPX-Y 6202-31
database_cross_reference: ChemIDplus

2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
type: Class
subclass of: CHEBI_25384
subclass of: CHEBI_35618
subclass of: CHEBI_36683
subclass of: CHEBI_38771
definition: A monocarboxylic acid that is 2-phenoxypropanoic acid in which the phenyl group is substituted at the para position by a (6-chloroquinoxalin-2-yl)oxy group.
charge: 0
formula: C17H13ClN2O4
inchi: InChI=1S/C17H13ClN2O4/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-15-8-11(18)2-7-14(15)20-16/h2-10H,1H3,(H,21,22)
inchikey: ABOOPXYCKNFDNJ-UHFFFAOYSA-N
mass: 344.750
monoisotopicmass: 344.05638
has exact synonym: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
has OBO namespace: chebi_ontology
has related synonym: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid
id: CHEBI:137509
in subset: 3 STAR

Axiom
annotated source: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
annotated property: has exact synonym
annotated target: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
annotated property: hasRelatedSynonym
annotated target: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid
database_cross_reference: ChEBI

(S)-quizalofop
type: Class
subclass of: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
subclass of: Restriction
  on property: is enantiomer of
  some values from: quizalofop-P
definition: A 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid that has S configuration. It is the (inactive) enantiomer of the herbicide quizalofop-P.
charge: 0
formula: C17H13ClN2O4
inchi: InChI=1S/C17H13ClN2O4/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-15-8-11(18)2-7-14(15)20-16/h2-10H,1H3,(H,21,22)/t10-/m0/s1
inchikey: ABOOPXYCKNFDNJ-JTQLQIEISA-N
mass: 344.750
monoisotopicmass: 344.05638
has exact synonym: (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
has OBO namespace: chebi_ontology
has related synonym: (-)-quizalofop
has related synonym: (-)-quizalofop-acid
has related synonym: (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid
id: CHEBI:137513
in subset: 3 STAR

Axiom
annotated source: (S)-quizalofop
annotated property: has exact synonym
annotated target: (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-quizalofop
annotated property: hasRelatedSynonym
annotated target: (-)-quizalofop
database_cross_reference: ChEBI

Axiom
annotated source: (S)-quizalofop
annotated property: hasRelatedSynonym
annotated target: (-)-quizalofop-acid
database_cross_reference: ChEBI

Axiom
annotated source: (S)-quizalofop
annotated property: hasRelatedSynonym
annotated target: (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionic acid
database_cross_reference: ChEBI

EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
type: Class
subclass of: CHEBI_76835
definition: An EC 1.1.1.* (oxidoreductase acting on donor CH-OH group, NAD(+) or NADP(+) acceptor) inhibitor that interferes with the action of 11beta-hydroxysteroid dehydrogenase (EC 1.1.1.146).
has OBO namespace: chebi_ontology
has related synonym: 11beta-hydroxy steroid dehydrogenase inhibitor
has related synonym: 11beta-hydroxy steroid dehydrogenase inhibitors
has related synonym: 11beta-hydroxysteroid dehydrogenase inhibitor
has related synonym: 11beta-hydroxysteroid dehydrogenase inhibitors
has related synonym: 11beta-hydroxysteroid dehydrogenase type 1 inhibitor
has related synonym: 11beta-hydroxysteroid dehydrogenase type 1 inhibitors
has related synonym: 11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitor
has related synonym: 11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitors
has related synonym: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitors
has related synonym: EC 1.1.1.146 inhibitor
has related synonym: EC 1.1.1.146 inhibitors
has related synonym: beta-hydroxysteroid dehydrogenase inhibitor
has related synonym: beta-hydroxysteroid dehydrogenase inhibitors
has related synonym: corticosteroid 11-reductase inhibitor
has related synonym: corticosteroid 11-reductase inhibitors
has related synonym: corticosteroid 11beta-dehydrogenase inhibitor
has related synonym: corticosteroid 11beta-dehydrogenase inhibitors
has related synonym: dehydrogenase, 11beta-hydroxy steroid inhibitor
has related synonym: dehydrogenase, 11beta-hydroxy steroid inhibitors
id: CHEBI:137626
in subset: 3 STAR

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxy steroid dehydrogenase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxy steroid dehydrogenase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid dehydrogenase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid dehydrogenase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid dehydrogenase type 1 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid dehydrogenase type 1 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 11beta-hydroxysteroid:NADP(+) 11-oxidoreductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.1.1.146 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.1.1.146 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: beta-hydroxysteroid dehydrogenase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: beta-hydroxysteroid dehydrogenase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: corticosteroid 11-reductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: corticosteroid 11-reductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: corticosteroid 11beta-dehydrogenase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: corticosteroid 11beta-dehydrogenase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: dehydrogenase, 11beta-hydroxy steroid inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor
annotated property: hasRelatedSynonym
annotated target: dehydrogenase, 11beta-hydroxy steroid inhibitors
database_cross_reference: ChEBI

ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
type: Class
subclass of: CHEBI_23990
subclass of: CHEBI_35618
subclass of: CHEBI_36683
subclass of: CHEBI_38771
subclass of: Restriction
  on property: has functional parent
  some values from: 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid
definition: An ethyl ester resulting from the formal condensation of the carboxy group of 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoic acid with ethanol.
charge: 0
formula: C19H17ClN2O4
inchi: InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3
inchikey: OSUHJPCHFDQAIT-UHFFFAOYSA-N
mass: 372.803
monoisotopicmass: 372.08768
database_cross_reference: PPDB:582
has exact synonym: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
has OBO namespace: chebi_ontology
has related synonym: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionate
id: CHEBI:137937
in subset: 3 STAR

Axiom
annotated source: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
annotated property: has exact synonym
annotated target: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
annotated property: hasRelatedSynonym
annotated target: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionate
database_cross_reference: ChEBI

quizalofop-P-ethyl
type: Class
subclass of: quinoxaline herbicide
subclass of: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
subclass of: Restriction
  on property: has role
  some values from: proherbicide
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33286
subclass of: Restriction
  on property: has functional parent
  some values from: quizalofop-P
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-quizalofop-ethyl
definition: An ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate that has R configuration. A proherbicide for quizalofop-P, it is used to control annual and perennial grass weeds in a variety of crops, including potatoes, sugar beet, peanuts, cotton and flax.
charge: 0
formula: C19H17ClN2O4
inchi: InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m1/s1
inchikey: OSUHJPCHFDQAIT-GFCCVEGCSA-N
mass: 372.803
monoisotopicmass: 372.08768
database_cross_reference: CAS:100646-51-3
database_cross_reference: PMID:17090107
database_cross_reference: PMID:17938739
database_cross_reference: PMID:24964043
database_cross_reference: PMID:26139867
database_cross_reference: PMID:26971169
database_cross_reference: PMID:27987479
database_cross_reference: PMID:28027504
database_cross_reference: PMID:28027508
database_cross_reference: PMID:28490371
database_cross_reference: PPDB:583
database_cross_reference: Pesticides:derivatives/quizalofop-p-ethyl
database_cross_reference: Reaxys:13263419
database_cross_reference: Reaxys:9648298
has exact synonym: ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
has OBO namespace: chebi_ontology
has related synonym: (+)-quizalofop-ethyl
has related synonym: ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionate
id: CHEBI:137938
in subset: 3 STAR

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: CAS:100646-51-3
source: Alan Wood's Pesticides

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: CAS:100646-51-3
source: ChemIDplus

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: CAS:100646-51-3
source: NIST Chemistry WebBook

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:17090107
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:17938739
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:24964043
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:26139867
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:26971169
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:27987479
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:28027504
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:28027508
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: PMID:28490371
source: Europe PMC

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: Pesticides:derivatives/quizalofop-p-ethyl
source: Alan Wood's Pesticides

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: Reaxys:13263419
source: Reaxys

Axiom
annotated source: quizalofop-P-ethyl
annotated property: database_cross_reference
annotated target: Reaxys:9648298
source: Reaxys

Axiom
annotated source: quizalofop-P-ethyl
annotated property: has exact synonym
annotated target: ethyl (2R)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: quizalofop-P-ethyl
annotated property: hasRelatedSynonym
annotated target: (+)-quizalofop-ethyl
database_cross_reference: ChEBI

Axiom
annotated source: quizalofop-P-ethyl
annotated property: hasRelatedSynonym
annotated target: ethyl (2R)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionate
database_cross_reference: Alan_Wood's_Pesticides

(S)-quizalofop-ethyl
type: Class
subclass of: ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
subclass of: Restriction
  on property: is enantiomer of
  some values from: quizalofop-P-ethyl
definition: An ethyl 2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate that has S configuration.
charge: 0
formula: C19H17ClN2O4
inchi: InChI=1S/C19H17ClN2O4/c1-3-24-19(23)12(2)25-14-5-7-15(8-6-14)26-18-11-21-17-10-13(20)4-9-16(17)22-18/h4-12H,3H2,1-2H3/t12-/m0/s1
inchikey: OSUHJPCHFDQAIT-LBPRGKRZSA-N
mass: 372.803
monoisotopicmass: 372.08768
database_cross_reference: PMID:22566128
has exact synonym: ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
has OBO namespace: chebi_ontology
has related synonym: ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionate
id: CHEBI:137939
in subset: 3 STAR

Axiom
annotated source: (S)-quizalofop-ethyl
annotated property: database_cross_reference
annotated target: PMID:22566128
source: Europe PMC

Axiom
annotated source: (S)-quizalofop-ethyl
annotated property: has exact synonym
annotated target: ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-quizalofop-ethyl
annotated property: hasRelatedSynonym
annotated target: ethyl (2S)-2-{4-[(6-chloroquinoxalin-2-yl)oxy]phenoxy}propionate
database_cross_reference: ChEBI

1,3-dichloropropane
type: Class
subclass of: CHEBI_23115
subclass of: CHEBI_23128
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25491
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: A chloroalkane that is propane in which a hydrogen from each of the terminal methyl groups has been replaced by a chlorine.
charge: 0
formula: C3H6Cl2
inchi: InChI=1S/C3H6Cl2/c4-2-1-3-5/h1-3H2
inchikey: YHRUOJUYPBUZOS-UHFFFAOYSA-N
mass: 112.986
monoisotopicmass: 111.98466
smiles: ClCCCCl
database_cross_reference: AGR:IND23328194
database_cross_reference: CAS:142-28-9
database_cross_reference: PMID:14709629
database_cross_reference: PMID:28416262
database_cross_reference: PMID:9008720
database_cross_reference: Patent:EP1067105
database_cross_reference: Reaxys:505960
has exact synonym: 1,3-dichloropropane
has OBO namespace: chebi_ontology
has related synonym: 1,3-DCP
has related synonym: CH2ClCH2CH2Cl
has related synonym: Cl(CH2)3Cl
has related synonym: ClCH2CH2CH2Cl
has related synonym: trimethylene dichloride
id: CHEBI:137978
in subset: 3 STAR

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: AGR:IND23328194
source: Europe PMC

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: CAS:142-28-9
source: ChemIDplus

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: CAS:142-28-9
source: NIST Chemistry WebBook

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: PMID:14709629
source: Europe PMC

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: PMID:28416262
source: Europe PMC

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: PMID:9008720
source: Europe PMC

Axiom
annotated source: 1,3-dichloropropane
annotated property: database_cross_reference
annotated target: Reaxys:505960
source: Reaxys

Axiom
annotated source: 1,3-dichloropropane
annotated property: has exact synonym
annotated target: 1,3-dichloropropane
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 1,3-dichloropropane
annotated property: has exact synonym
annotated target: 1,3-dichloropropane
database_cross_reference: UniProt

Axiom
annotated source: 1,3-dichloropropane
annotated property: hasRelatedSynonym
annotated target: 1,3-DCP
database_cross_reference: ChEBI

Axiom
annotated source: 1,3-dichloropropane
annotated property: hasRelatedSynonym
annotated target: CH2ClCH2CH2Cl
database_cross_reference: ChEBI

Axiom
annotated source: 1,3-dichloropropane
annotated property: hasRelatedSynonym
annotated target: Cl(CH2)3Cl
database_cross_reference: ChEBI

Axiom
annotated source: 1,3-dichloropropane
annotated property: hasRelatedSynonym
annotated target: ClCH2CH2CH2Cl
database_cross_reference: ChEBI

Axiom
annotated source: 1,3-dichloropropane
annotated property: hasRelatedSynonym
annotated target: trimethylene dichloride
database_cross_reference: ChemIDplus

metalloid atom
type: Class
subclass of: CHEBI_33250
definition: An atom of an element that exhibits properties that are between those of metals and nonmetals, or that has a mixture of them. The term generally includes boron, silicon, germanium, arsenic, antimony, and tellurium, while carbon, aluminium, selenium, polonium, and astatine are less commonly included.
database_cross_reference: Wikipedia:Metalloid
has OBO namespace: chebi_ontology
has related synonym: metalloid
has related synonym: metalloids
id: CHEBI:137980
in subset: 3 STAR

Axiom
annotated source: metalloid atom
annotated property: hasRelatedSynonym
annotated target: metalloid
database_cross_reference: ChEBI

Axiom
annotated source: metalloid atom
annotated property: hasRelatedSynonym
annotated target: metalloids
database_cross_reference: ChEBI

tertiary ammonium ion
type: Class
subclass of: CHEBI_25697
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_50996
definition: An organic cation obtained by protonation of the amino group of any tertiary amino compound.
charge: +1
formula: HNR3
mass: 15.015
monoisotopicmass: 15.01090
smiles: [NH+](*)(*)*
has OBO namespace: chebi_ontology
has related synonym: a tertiary amine
has related synonym: tertiary amine(1+)
has related synonym: tertiary ammonium ions
id: CHEBI:137982
in subset: 3 STAR

Axiom
annotated source: tertiary ammonium ion
annotated property: hasRelatedSynonym
annotated target: a tertiary amine
database_cross_reference: UniProt

Axiom
annotated source: tertiary ammonium ion
annotated property: hasRelatedSynonym
annotated target: tertiary amine(1+)
database_cross_reference: ChEBI

Axiom
annotated source: tertiary ammonium ion
annotated property: hasRelatedSynonym
annotated target: tertiary ammonium ions
database_cross_reference: ChEBI

3-(1-methylpyrrolidin-2-yl)pyridine
type: Class
subclass of: CHEBI_26416
subclass of: CHEBI_26456
subclass of: CHEBI_46775
definition: An N-alkylpyrrolidine that consists of N-methylpyrrolidine bearing a pyridin-3-yl substituent at position 2.
charge: 0
formula: C10H14N2
inchi: InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3
inchikey: SNICXCGAKADSCV-UHFFFAOYSA-N
mass: 162.232
monoisotopicmass: 162.11570
smiles: C=1C=C(C2N(CCC2)C)C=NC1
has exact synonym: 3-(1-methylpyrrolidin-2-yl)pyridine
has OBO namespace: chebi_ontology
id: CHEBI:138000
in subset: 3 STAR

Axiom
annotated source: 3-(1-methylpyrrolidin-2-yl)pyridine
annotated property: has exact synonym
annotated target: 3-(1-methylpyrrolidin-2-yl)pyridine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

2-bromophenyl 2,4-dibromophenyl ether
type: Class
subclass of: polybromodiphenyl ether
definition: A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 2', and 4 positions have been replaced by bromines.
charge: 0
formula: C12H7Br3O
inchi: InChI=1S/C12H7Br3O/c13-8-5-6-12(10(15)7-8)16-11-4-2-1-3-9(11)14/h1-7H
inchikey: VYBFILXLBMWOLI-UHFFFAOYSA-N
mass: 406.894
monoisotopicmass: 403.80470
smiles: O(C=1C=CC=CC1Br)C=2C(=CC(=CC2)Br)Br
database_cross_reference: CAS:147217-75-2
database_cross_reference: PMID:23959216
database_cross_reference: PMID:25463252
database_cross_reference: PMID:26791419
database_cross_reference: PMID:26809479
database_cross_reference: PMID:27836138
database_cross_reference: PMID:28013469
database_cross_reference: PMID:28167443
database_cross_reference: PMID:28293827
database_cross_reference: Reaxys:8410171
has exact synonym: 2-bromophenyl 2,4-dibromophenyl ether
has OBO namespace: chebi_ontology
has related synonym: 2,2',4-triBDE
has related synonym: 2,2',4-tribromodiphenyl ether
has related synonym: 2,4-dibromo-1-(2-bromophenoxy)benzene
has related synonym: 2,4-dibromophenyl 2-bromophenyl ether
has related synonym: 2-bromophenyl(2,4-dibromophenyl) ether
has related synonym: BDE 17
has related synonym: BDE-17
has related synonym: PBDE 17
has related synonym: PBDE-17
id: CHEBI:138001
in subset: 3 STAR

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:147217-75-2
source: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:23959216
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:25463252
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26791419
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26809479
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:27836138
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28013469
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28167443
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28293827
source: Europe PMC

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: Reaxys:8410171
source: Reaxys

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: has exact synonym
annotated target: 2-bromophenyl 2,4-dibromophenyl ether
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,2',4-triBDE
database_cross_reference: ChEBI

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,2',4-tribromodiphenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4-dibromo-1-(2-bromophenoxy)benzene
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4-dibromophenyl 2-bromophenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2-bromophenyl(2,4-dibromophenyl) ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE 17
database_cross_reference: ChEBI

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE-17
database_cross_reference: ChEBI

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE 17
database_cross_reference: ChemIDplus

Axiom
annotated source: 2-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE-17
database_cross_reference: ChEBI

endocrine disruptor
type: Class
subclass of: CHEBI_51061
definition: Any compound that can disrupt the functions of the endocrine (hormone) system
database_cross_reference: PMID:27929035
database_cross_reference: PMID:28356401
database_cross_reference: PMID:28526231
database_cross_reference: Wikipedia:Endocrine_disruptor
has OBO namespace: chebi_ontology
has related synonym: endocrine disrupting chemical
has related synonym: endocrine disrupting chemicals
has related synonym: endocrine disrupting compound
has related synonym: endocrine disrupting compounds
has related synonym: endocrine disruptors
has related synonym: endocrine-disrupting chemical
has related synonym: endocrine-disrupting chemicals
has related synonym: hormonally active agent
has related synonym: hormonally active agents
id: CHEBI:138015
in subset: 3 STAR

Axiom
annotated source: endocrine disruptor
annotated property: database_cross_reference
annotated target: PMID:27929035
source: Europe PMC

Axiom
annotated source: endocrine disruptor
annotated property: database_cross_reference
annotated target: PMID:28356401
source: Europe PMC

Axiom
annotated source: endocrine disruptor
annotated property: database_cross_reference
annotated target: PMID:28526231
source: Europe PMC

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine disrupting chemical
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine disrupting chemicals
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine disrupting compound
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine disrupting compounds
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine disruptors
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine-disrupting chemical
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: endocrine-disrupting chemicals
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: hormonally active agent
database_cross_reference: ChEBI

Axiom
annotated source: endocrine disruptor
annotated property: hasRelatedSynonym
annotated target: hormonally active agents
database_cross_reference: ChEBI

4-bromophenyl 2,4-dibromophenyl ether
type: Class
subclass of: polybromodiphenyl ether
definition: A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 4, and 4' positions have been replaced by bromines.
charge: 0
formula: C12H7Br3O
inchi: InChI=1S/C12H7Br3O/c13-8-1-4-10(5-2-8)16-12-6-3-9(14)7-11(12)15/h1-7H
inchikey: UPNBETHEXPIWQX-UHFFFAOYSA-N
mass: 406.894
monoisotopicmass: 403.80470
smiles: O(C=1C=CC(=CC1Br)Br)C=2C=CC(=CC2)Br
database_cross_reference: CAS:41318-75-6
database_cross_reference: PMID:22266365
database_cross_reference: PMID:24191540
database_cross_reference: PMID:24191731
database_cross_reference: PMID:26743650
database_cross_reference: PMID:27573363
database_cross_reference: PMID:28293827
database_cross_reference: PMID:28436496
database_cross_reference: PMID:28557710
database_cross_reference: Reaxys:2530803
has exact synonym: 4-bromophenyl 2,4-dibromophenyl ether
has OBO namespace: chebi_ontology
has related synonym: 2,4,4'-triBDE
has related synonym: 2,4,4'-tribrominated diphenyl ether
has related synonym: 2,4,4'-tribromodiphenyl ether
has related synonym: 2,4-dibromo-1-(4-bromophenoxy)benzene
has related synonym: BDE-28
has related synonym: BDE28
has related synonym: PBDE 28
has related synonym: PBDE-28
has related synonym: tribromodiphenyl ether 28
id: CHEBI:138036
in subset: 3 STAR

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:41318-75-6
source: ChemIDplus

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:41318-75-6
source: NIST Chemistry WebBook

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:22266365
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:24191540
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:24191731
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26743650
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:27573363
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28293827
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28436496
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28557710
source: Europe PMC

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: Reaxys:2530803
source: Reaxys

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: has exact synonym
annotated target: 4-bromophenyl 2,4-dibromophenyl ether
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4,4'-triBDE
database_cross_reference: ChEBI

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4,4'-tribrominated diphenyl ether
database_cross_reference: ChEBI

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4,4'-tribromodiphenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4-dibromo-1-(4-bromophenoxy)benzene
database_cross_reference: ChEBI

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE-28
database_cross_reference: ChemIDplus

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE28
database_cross_reference: ChEBI

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE 28
database_cross_reference: ChemIDplus

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE-28
database_cross_reference: ChEBI

Axiom
annotated source: 4-bromophenyl 2,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: tribromodiphenyl ether 28
database_cross_reference: ChemIDplus

2,4-dibromophenyl 3,4-dibromophenyl ether
type: Class
subclass of: polybromodiphenyl ether
definition: A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 4, 3', and 4' positions have been replaced by bromines.
charge: 0
formula: C12H6Br4O
inchi: InChI=1S/C12H6Br4O/c13-7-1-4-12(11(16)5-7)17-8-2-3-9(14)10(15)6-8/h1-6H
inchikey: DHUMTYRHKMCVAG-UHFFFAOYSA-N
mass: 485.790
monoisotopicmass: 481.71522
smiles: O(C=1C=CC(=CC1Br)Br)C=2C=CC(=C(C2)Br)Br
database_cross_reference: CAS:189084-61-5
database_cross_reference: PMID:24290225
database_cross_reference: PMID:26194239
database_cross_reference: PMID:26942685
database_cross_reference: PMID:28013469
database_cross_reference: PMID:28293827
database_cross_reference: Reaxys:8417297
has exact synonym: 1,2-dibromo-4-(2,4-dibromophenoxy)benzene
has OBO namespace: chebi_ontology
has related synonym: 2,3',4,4'-tetra-BDE
has related synonym: 2,3',4,4'-tetrabromodiphenyl ether
has related synonym: 2,4,3',4`-tetrabromodiphenyl ether
has related synonym: 2,4-dibromo-1-(3,4-dibromophenoxy)benzene
has related synonym: BDE 66
has related synonym: BDE-66
has related synonym: PBDE 66
has related synonym: PBDE-66
id: CHEBI:138038
in subset: 3 STAR

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:189084-61-5
source: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:189084-61-5
source: NIST Chemistry WebBook

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:24290225
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26194239
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26942685
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28013469
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28293827
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: database_cross_reference
annotated target: Reaxys:8417297
source: Reaxys

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: has exact synonym
annotated target: 1,2-dibromo-4-(2,4-dibromophenoxy)benzene
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,3',4,4'-tetra-BDE
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,3',4,4'-tetrabromodiphenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4,3',4`-tetrabromodiphenyl ether
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,4-dibromo-1-(3,4-dibromophenoxy)benzene
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE 66
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE-66
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE 66
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 3,4-dibromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE-66
database_cross_reference: ChEBI

2,4-dibromophenyl 2,3,4-tribromophenyl ether
type: Class
subclass of: polybromodiphenyl ether
definition: A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 3, 4, 2', and 4' positions have been replaced by bromines.
charge: 0
formula: C12H5Br5O
inchi: InChI=1S/C12H5Br5O/c13-6-1-3-9(8(15)5-6)18-10-4-2-7(14)11(16)12(10)17/h1-5H
inchikey: DMLQSUZPTTUUDP-UHFFFAOYSA-N
mass: 564.686
monoisotopicmass: 559.62573
database_cross_reference: CAS:182346-21-0
database_cross_reference: HMDB:HMDB0037516
database_cross_reference: PMID:18762292
database_cross_reference: PMID:21772022
database_cross_reference: PMID:26785211
database_cross_reference: PMID:26942685
database_cross_reference: PMID:28013469
database_cross_reference: Reaxys:7538430
has exact synonym: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
has OBO namespace: chebi_ontology
has related synonym: 1,2,3-tribromo-4-(2,4-dibromophenoxy)benzene
has related synonym: 2,2',3,4,4'-penta-BDE
has related synonym: 2,2',3,4,4'-pentabromodiphenyl ether
has related synonym: BDE 85
has related synonym: BDE-85
has related synonym: PBDE 85
has related synonym: PBDE-85
id: CHEBI:138064
in subset: 3 STAR

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:182346-21-0
source: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:18762292
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:21772022
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26785211
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26942685
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28013469
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: database_cross_reference
annotated target: Reaxys:7538430
source: Reaxys

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: has exact synonym
annotated target: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 1,2,3-tribromo-4-(2,4-dibromophenoxy)benzene
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,2',3,4,4'-penta-BDE
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,2',3,4,4'-pentabromodiphenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE 85
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE-85
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE 85
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,3,4-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE-85
database_cross_reference: ChEBI

2,4-dibromophenyl 2,4,6-tribromophenyl ether
type: Class
subclass of: polybromodiphenyl ether
definition: A polybromodiphenyl ether that is diphenyl ether in which the hydrogens at the 2, 4, 6, 2', and 4' positions have been replaced by bromines.
charge: 0
formula: C12H5Br5O
inchi: InChI=1S/C12H5Br5O/c13-6-1-2-11(8(15)3-6)18-12-9(16)4-7(14)5-10(12)17/h1-5H
inchikey: NSKIRYMHNFTRLR-UHFFFAOYSA-N
mass: 564.686
monoisotopicmass: 559.62573
database_cross_reference: CAS:189084-64-8
database_cross_reference: HMDB:HMDB0037516
database_cross_reference: PMID:16507514
database_cross_reference: PMID:21390402
database_cross_reference: PMID:22884212
database_cross_reference: PMID:23302053
database_cross_reference: PMID:25629761
database_cross_reference: PMID:26906616
database_cross_reference: PMID:27068391
database_cross_reference: PMID:27234317
database_cross_reference: PMID:28395225
database_cross_reference: PMID:28557710
database_cross_reference: Reaxys:8152285
has exact synonym: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
has OBO namespace: chebi_ontology
has related synonym: 1,3,5-tribromo-2-(2,4-dibromophenoxy)benzene
has related synonym: 2,2',4,4',6-brominated diphenyl ether
has related synonym: BDE 100
has related synonym: BDE-100
has related synonym: BDE100
has related synonym: PBDE 100
has related synonym: PBDE-100
has related synonym: PBDE100
has related synonym: pentabrominated diphenyl ether 100
id: CHEBI:138065
in subset: 3 STAR

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: CAS:189084-64-8
source: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:16507514
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:21390402
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:22884212
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:23302053
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:25629761
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:26906616
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:27068391
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:27234317
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28395225
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: PMID:28557710
source: Europe PMC

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: database_cross_reference
annotated target: Reaxys:8152285
source: Reaxys

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: has exact synonym
annotated target: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 1,3,5-tribromo-2-(2,4-dibromophenoxy)benzene
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: 2,2',4,4',6-brominated diphenyl ether
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE 100
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE-100
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: BDE100
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE 100
database_cross_reference: ChemIDplus

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE-100
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: PBDE100
database_cross_reference: ChEBI

Axiom
annotated source: 2,4-dibromophenyl 2,4,6-tribromophenyl ether
annotated property: hasRelatedSynonym
annotated target: pentabrominated diphenyl ether 100
database_cross_reference: ChemIDplus

perfluorooctanesulfonamide
type: Class
subclass of: perfluorinated compound
subclass of: CHEBI_35358
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77853
definition: A perfluorinated compound that is perfluorooctane in which one of the terminal fluorines has been replace by a sulfamoyl group.
charge: 0
formula: C8H2F17NO2S
inchi: InChI=1S/C8H2F17NO2S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H2,26,27,28)
inchikey: RRRXPPIDPYTNJG-UHFFFAOYSA-N
mass: 499.146
monoisotopicmass: 498.95348
database_cross_reference: CAS:754-91-6
database_cross_reference: PMID:16720684
database_cross_reference: PMID:16786681
database_cross_reference: PMID:17295423
database_cross_reference: PMID:17384769
database_cross_reference: PMID:18007991
database_cross_reference: PMID:20951402
database_cross_reference: PMID:25222623
database_cross_reference: PMID:26053759
database_cross_reference: PMID:27239709
database_cross_reference: PMID:27276029
database_cross_reference: PMID:28092384
database_cross_reference: PMID:28350446
database_cross_reference: Reaxys:1813858
database_cross_reference: Wikipedia:Perfluorooctanesulfonamide
has exact synonym: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide
has OBO namespace: chebi_ontology
has related synonym: PFOSA
has related synonym: heptadecafluorooctanesulphonamide
has related synonym: perfluoroctylsulfonamide
has related synonym: perfluorooctane sulfonamide
has related synonym: perfluorooctanesulfonic acid amide
id: CHEBI:138089
in subset: 3 STAR

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: CAS:754-91-6
source: ChemIDplus

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:16720684
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:16786681
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:17295423
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:17384769
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:18007991
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:20951402
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:25222623
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:26053759
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:27239709
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:27276029
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:28092384
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: PMID:28350446
source: Europe PMC

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: database_cross_reference
annotated target: Reaxys:1813858
source: Reaxys

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: has exact synonym
annotated target: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: hasRelatedSynonym
annotated target: PFOSA
database_cross_reference: ChEBI

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: hasRelatedSynonym
annotated target: heptadecafluorooctanesulphonamide
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: hasRelatedSynonym
annotated target: perfluoroctylsulfonamide
database_cross_reference: ChemIDplus

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: hasRelatedSynonym
annotated target: perfluorooctane sulfonamide
database_cross_reference: ChEBI

Axiom
annotated source: perfluorooctanesulfonamide
annotated property: hasRelatedSynonym
annotated target: perfluorooctanesulfonic acid amide
database_cross_reference: ChemIDplus

inorganic acid
type: Class
subclass of: CHEBI_39141
definition: A Bronsted acid derived from one or more inorganic compounds. Inorganic acids (also known as mineral acids) form hydrons and conjugate base ions when dissolved in water.
database_cross_reference: Wikipedia:Mineral_acid
has OBO namespace: chebi_ontology
has related synonym: inorganic acids
has related synonym: mineral acid
has related synonym: mineral acids
id: CHEBI:138103
in subset: 3 STAR

Axiom
annotated source: inorganic acid
annotated property: hasRelatedSynonym
annotated target: inorganic acids
database_cross_reference: ChEBI

Axiom
annotated source: inorganic acid
annotated property: hasRelatedSynonym
annotated target: mineral acid
database_cross_reference: ChEBI

Axiom
annotated source: inorganic acid
annotated property: hasRelatedSynonym
annotated target: mineral acids
database_cross_reference: ChEBI

17alpha-hydroxy-C21-steroid
type: Class
subclass of: CHEBI_35342
subclass of: CHEBI_61313
definition: Any C21-steroid carrying a hydroxy substituent at the 17alpha-position. Note that individual examples may have ring substituents at other positions and/or contain double bonds, aromatic A-rings, expanded/contracted rings etc., so the formula and mass may vary from that given for the generic structure.
charge: 0
formula: C21H36O
inchi: InChI=1S/C21H36O/c1-4-21(22)14-11-18-16-9-8-15-7-5-6-12-19(15,2)17(16)10-13-20(18,21)3/h15-18,22H,4-14H2,1-3H3/t15?,16?,17?,18?,19?,20?,21-/m1/s1
inchikey: JSIVWCLRCGAVHN-ILZKQPLKSA-N
mass: 304.511
monoisotopicmass: 304.27662
database_cross_reference: MetaCyc:17a-hydroxy-C21-steroids
has OBO namespace: chebi_ontology
has related synonym: a 17alpha-hydroxy-C21-steroid
id: CHEBI:138141
in subset: 3 STAR

Axiom
annotated source: 17alpha-hydroxy-C21-steroid
annotated property: database_cross_reference
annotated target: MetaCyc:17a-hydroxy-C21-steroids
source: SUBMITTER

Axiom
annotated source: 17alpha-hydroxy-C21-steroid
annotated property: hasRelatedSynonym
annotated target: a 17alpha-hydroxy-C21-steroid
database_cross_reference: UniProt

fomesafen(1-)
type: Class
subclass of: CHEBI_50335
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_81925
definition: An organic nitrogen anion resulting from the removal of a proton from the N-sulfonylcarboxamide moiety of fomesafen.
charge: -1
formula: C15H9ClF3N2O6S
inchikey: BGZZWXTVIYUUEY-UHFFFAOYSA-M
mass: 437.757
monoisotopicmass: 436.98274
smiles: C1=C(C=C(C(=C1)OC2=CC=C(C(=C2)C(=O)[N-]S(C)(=O)=O)[N+]([O-])=O)Cl)C(F)(F)F
has exact synonym: {5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoyl}(methylsulfonyl)azanide
has OBO namespace: chebi_ontology
id: CHEBI:138163
in subset: 3 STAR

Axiom
annotated source: fomesafen(1-)
annotated property: has exact synonym
annotated target: {5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoyl}(methylsulfonyl)azanide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

carotenoid biosynthesis inhibitor
type: Class
subclass of: CHEBI_76932
definition: Any pathway inhibitor that acts on the carotenoid biosynthesis pathway.
has OBO namespace: chebi_ontology
has related synonym: carotenogenesis inhibitor
has related synonym: carotenogenesis inhibitors
has related synonym: carotenoid biosynthesis inhibitors
has related synonym: carotenoid-biosynthesis inhibitor
has related synonym: carotenoid-biosynthesis inhibitors
id: CHEBI:138208
in subset: 3 STAR

Axiom
annotated source: carotenoid biosynthesis inhibitor
annotated property: hasRelatedSynonym
annotated target: carotenogenesis inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: carotenoid biosynthesis inhibitor
annotated property: hasRelatedSynonym
annotated target: carotenogenesis inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: carotenoid biosynthesis inhibitor
annotated property: hasRelatedSynonym
annotated target: carotenoid biosynthesis inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: carotenoid biosynthesis inhibitor
annotated property: hasRelatedSynonym
annotated target: carotenoid-biosynthesis inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: carotenoid biosynthesis inhibitor
annotated property: hasRelatedSynonym
annotated target: carotenoid-biosynthesis inhibitors
database_cross_reference: ChEBI

bile acids
type: Class
subclass of: CHEBI_25384
subclass of: CHEBI_35350
subclass of: CHEBI_36078
definition: Any member of a group of hydroxy steroids occuring in bile, where they are present as the sodium salts of their amides with glycine or taurine. In mammals bile acids almost invariably have 5beta-configuration, while in lower vertebrates, some bile acids, known as allo-bile acids, have 5alpha-configuration.
has OBO namespace: chebi_ontology
id: CHEBI:138366
in subset: 3 STAR

apoprotein
type: Class
subclass of: CHEBI_38560
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
definition: An apoprotein is a protein devoid of its characteristic prosthetic group or metal.
database_cross_reference: KEGG:C16240
has exact synonym: apoprotein
has OBO namespace: chebi_ontology
has related synonym: apoproteins
id: CHEBI:13850
in subset: 3 STAR

Axiom
annotated source: apoprotein
annotated property: has exact synonym
annotated target: apoprotein
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: apoprotein
annotated property: hasRelatedSynonym
annotated target: apoproteins
database_cross_reference: ChEBI

dialkyl phosphate(1-)
type: Class
subclass of: CHEBI_58945
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_16648
definition: An organophosphate oxoanion obtained by deprotonation of the phosphate OH group of any dialkyl phosphate; major species at pH 7.3.
charge: -1
formula: O4PR2
mass: 94.971
monoisotopicmass: 94.95342
smiles: P(O*)(O*)([O-])=O
has OBO namespace: chebi_ontology
has related synonym: a dialkyl phosphate
id: CHEBI:138518
in subset: 3 STAR

Axiom
annotated source: dialkyl phosphate(1-)
annotated property: hasRelatedSynonym
annotated target: a dialkyl phosphate
database_cross_reference: UniProt

(+)-jasmonic acid anion
type: Class
subclass of: jasmonic acid anion
subclass of: Restriction
  on property: is conjugate base of
  some values from: (+)-jasmonic acid
definition: A jasmonate anion resulting from the removal of a proton from the carboxy group of (+)-jasmonic acid; major species at pH 7.3.
charge: -1
formula: C12H17O3
inchi: InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/p-1/b4-3-/t9-,10-/m0/s1
inchikey: ZNJFBWYDHIGLCU-CMIOBCHKSA-M
mass: 209.262
monoisotopicmass: 209.11832
smiles: C(=O)([O-])C[C@H]1[C@@H](C(CC1)=O)C/C=C\CC
database_cross_reference: PMID:11287667
database_cross_reference: Pubchem:7251180
has exact synonym: {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetate
has OBO namespace: chebi_ontology
has related synonym: (1S,2S)-jasmonic acid anion
has related synonym: (3S,7S)-jasmonate
id: CHEBI:138625
in subset: 3 STAR

Axiom
annotated source: (+)-jasmonic acid anion
annotated property: database_cross_reference
annotated target: PMID:11287667
source: SUBMITTER

Axiom
annotated source: (+)-jasmonic acid anion
annotated property: database_cross_reference
annotated target: Pubchem:7251180
source: SUBMITTER

Axiom
annotated source: (+)-jasmonic acid anion
annotated property: has exact synonym
annotated target: {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (+)-jasmonic acid anion
annotated property: hasRelatedSynonym
annotated target: (1S,2S)-jasmonic acid anion
database_cross_reference: ChEBI

Axiom
annotated source: (+)-jasmonic acid anion
annotated property: hasRelatedSynonym
annotated target: (3S,7S)-jasmonate
database_cross_reference: UniProt

gas molecular entity
type: Class
subclass of: CHEBI_33579
definition: Any main group molecular entity that is gaseous at standard temperature and pressure (STP; 0degreeC and 100 kPa).
IAO_0000412: chebi.owl
database_cross_reference: Wikipedia:https://en.wikipedia.org/wiki/Gas
has OBO namespace: chebi_ontology
has related synonym: gas molecular entities
has related synonym: gaseous molecular entities
has related synonym: gaseous molecular entity
id: CHEBI:138675
in subset: 3 STAR

Axiom
annotated source: gas molecular entity
annotated property: hasRelatedSynonym
annotated target: gas molecular entities
database_cross_reference: ChEBI

Axiom
annotated source: gas molecular entity
annotated property: hasRelatedSynonym
annotated target: gaseous molecular entities
database_cross_reference: ChEBI

Axiom
annotated source: gas molecular entity
annotated property: hasRelatedSynonym
annotated target: gaseous molecular entity
database_cross_reference: ChEBI

autophagy inducer
type: Class
subclass of: CHEBI_52206
definition: Any compound that induces the process of autophagy (the self-digestion of one or more components of a cell through the action of enzymes originating within the same cell).
has OBO namespace: chebi_ontology
has related synonym: autophagocytosis inducer
has related synonym: autophagocytosis inducers
has related synonym: autophagy inducers
id: CHEBI:138880
in subset: 3 STAR

Axiom
annotated source: autophagy inducer
annotated property: hasRelatedSynonym
annotated target: autophagocytosis inducer
database_cross_reference: ChEBI

Axiom
annotated source: autophagy inducer
annotated property: hasRelatedSynonym
annotated target: autophagocytosis inducers
database_cross_reference: ChEBI

Axiom
annotated source: autophagy inducer
annotated property: hasRelatedSynonym
annotated target: autophagy inducers
database_cross_reference: ChEBI

carotenoid beta-end derivative
type: Class
subclass of: CHEBI_23044
definition: Any carotenoid derivative with an beta-end group
IAO_0000412: chebi.owl
charge: 0
formula: C19H27R
mass: 255.418
monoisotopicmass: 255.21128
smiles: C1(=C(CCCC1(C)C)C)/C=C/C(=C/C=C/C(=C/*)/C)/C
database_cross_reference: MetaCyc:Carotenoid-beta-end-group
has OBO namespace: chebi_ontology
has related synonym: a carotenoid beta-end derivative
id: CHEBI:139120
in subset: 2 STAR
label: carotenoid beta-end group

Axiom
annotated source: carotenoid beta-end derivative
annotated property: database_cross_reference
annotated target: MetaCyc:Carotenoid-beta-end-group
source: SUBMITTER

Axiom
annotated source: carotenoid beta-end derivative
annotated property: hasRelatedSynonym
annotated target: a carotenoid beta-end derivative
database_cross_reference: UniProt

secondary nitroalkane
type: Class
subclass of: CHEBI 7587
definition: A nitroalkane in which the nitro group, -NO2, is attached to a saturated carbon atom which has two other carbon atoms attached to it. Major microspecies at pH 7.3.
charge: 0
formula: CHNO2R2
mass: 59.024
monoisotopicmass: 59.00073
smiles: C([N+]([O-])=O)(*)*
database_cross_reference: PMID:15609931
database_cross_reference: PMID:1719412
database_cross_reference: PMID:22543734
database_cross_reference: PMID:7762004
database_cross_reference: PMID:9437534
has OBO namespace: chebi_ontology
has related synonym: a secondary nitroalkane
id: CHEBI:139218
in subset: 3 STAR

Axiom
annotated source: secondary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:15609931
source: Europe PMC

Axiom
annotated source: secondary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:1719412
source: Europe PMC

Axiom
annotated source: secondary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:22543734
source: Europe PMC

Axiom
annotated source: secondary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:7762004
source: Europe PMC

Axiom
annotated source: secondary nitroalkane
annotated property: database_cross_reference
annotated target: PMID:9437534
source: Europe PMC

Axiom
annotated source: secondary nitroalkane
annotated property: hasRelatedSynonym
annotated target: a secondary nitroalkane
database_cross_reference: UniProt

(+)-jasmonic acid
type: Class
subclass of: CHEBI_35871
subclass of: CHEBI_36140
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24937
subclass of: Restriction
  on property: is conjugate acid of
  some values from: (+)-jasmonic acid anion
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_18292
definition: An oxo monocarboxylic acid that is (3-oxocyclopentyl)acetic acid substituted by a (2Z)-pent-2-en-1-yl group at position 2 of the cyclopentane ring.
charge: 0
formula: C12H18O3
inchi: InChI=1S/C12H18O3/c1-2-3-4-5-10-9(8-12(14)15)6-7-11(10)13/h3-4,9-10H,2,5-8H2,1H3,(H,14,15)/b4-3-/t9-,10-/m0/s1
inchikey: ZNJFBWYDHIGLCU-CMIOBCHKSA-N
mass: 210.270
monoisotopicmass: 210.12559
smiles: C(=O)(O)C[C@H]1[C@@H](C(CC1)=O)C/C=C\CC
database_cross_reference: Reaxys:2415413
has exact synonym: {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetic acid
has OBO namespace: chebi_ontology
has related synonym: (1S,2S)-jasmonic acid
id: CHEBI:139300
in subset: 3 STAR

Axiom
annotated source: (+)-jasmonic acid
annotated property: database_cross_reference
annotated target: Reaxys:2415413
source: Reaxys

Axiom
annotated source: (+)-jasmonic acid
annotated property: has exact synonym
annotated target: {(1S,2S)-3-oxo-2-[(2 Z)-pent-2-en-1-yl]cyclopentyl}acetic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (+)-jasmonic acid
annotated property: hasRelatedSynonym
annotated target: (1S,2S)-jasmonic acid
database_cross_reference: ChEBI

TRP channel blocker
type: Class
subclass of: TRP channel modulator
definition: An agent that inhibits the passage of cations through the transient receptor potential (TRP) channels.
database_cross_reference: PMID:17445088
database_cross_reference: PMID:21198543
database_cross_reference: PMID:21607648
database_cross_reference: PMID:22308955
database_cross_reference: Wikipedia:Transient_receptor_potential_channel
has OBO namespace: chebi_ontology
has related synonym: TRP channel blockers
has related synonym: transient receptor potential channel blocker
has related synonym: transient receptor potential channel blockers
id: CHEBI:139361
in subset: 3 STAR

Axiom
annotated source: TRP channel blocker
annotated property: database_cross_reference
annotated target: PMID:17445088
source: Europe PMC

Axiom
annotated source: TRP channel blocker
annotated property: database_cross_reference
annotated target: PMID:21198543
source: Europe PMC

Axiom
annotated source: TRP channel blocker
annotated property: database_cross_reference
annotated target: PMID:21607648
source: Europe PMC

Axiom
annotated source: TRP channel blocker
annotated property: database_cross_reference
annotated target: PMID:22308955
source: Europe PMC

Axiom
annotated source: TRP channel blocker
annotated property: hasRelatedSynonym
annotated target: TRP channel blockers
database_cross_reference: ChEBI

Axiom
annotated source: TRP channel blocker
annotated property: hasRelatedSynonym
annotated target: transient receptor potential channel blocker
database_cross_reference: ChEBI

Axiom
annotated source: TRP channel blocker
annotated property: hasRelatedSynonym
annotated target: transient receptor potential channel blockers
database_cross_reference: ChEBI

carbamate
type: Class
subclass of: CHEBI_37022
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_28616
charge: -1
formula: CH2NO2
inchi: InChI=1S/CH3NO2/c2-1(3)4/h2H2,(H,3,4)/p-1
inchikey: KXDHJXZQYSOELW-UHFFFAOYSA-M
mass: 60.03212
monoisotopicmass: 60.00910
smiles: NC([O-])=O
database_cross_reference: Beilstein:3903503
database_cross_reference: CAS:302-11-4
database_cross_reference: Gmelin:239604
has exact synonym: carbamate
has OBO namespace: chebi_ontology
has related synonym: Carbamat
has related synonym: Karbamat
has related synonym: carbamate ion
has related synonym: carbamic acid, ion(1-)
id: CHEBI:13941
in subset: 3 STAR

Axiom
annotated source: carbamate
annotated property: database_cross_reference
annotated target: Beilstein:3903503
source: Beilstein

Axiom
annotated source: carbamate
annotated property: database_cross_reference
annotated target: CAS:302-11-4
source: ChemIDplus

Axiom
annotated source: carbamate
annotated property: database_cross_reference
annotated target: Gmelin:239604
source: Gmelin

Axiom
annotated source: carbamate
annotated property: has exact synonym
annotated target: carbamate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: carbamate
annotated property: has exact synonym
annotated target: carbamate
database_cross_reference: UniProt

Axiom
annotated source: carbamate
annotated property: hasRelatedSynonym
annotated target: Carbamat
database_cross_reference: ChEBI

Axiom
annotated source: carbamate
annotated property: hasRelatedSynonym
annotated target: Karbamat
database_cross_reference: ChEBI

Axiom
annotated source: carbamate
annotated property: hasRelatedSynonym
annotated target: carbamate ion
database_cross_reference: ChemIDplus

Axiom
annotated source: carbamate
annotated property: hasRelatedSynonym
annotated target: carbamic acid, ion(1-)
database_cross_reference: ChemIDplus

sensitiser
type: Class
subclass of: CHEBI_52209
definition: A chemical compound that causes a substantial proportion of exposed people or animals to develop an allergic reaction in normal tissue after repeated exposure to the compound.
has OBO namespace: chebi_ontology
has related synonym: sensitisers
has related synonym: sensitizer
has related synonym: sensitizers
id: CHEBI:139492
in subset: 3 STAR

Axiom
annotated source: sensitiser
annotated property: hasRelatedSynonym
annotated target: sensitisers
database_cross_reference: ChEBI

Axiom
annotated source: sensitiser
annotated property: hasRelatedSynonym
annotated target: sensitizer
database_cross_reference: ChEBI

Axiom
annotated source: sensitiser
annotated property: hasRelatedSynonym
annotated target: sensitizers
database_cross_reference: ChEBI

EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
type: Class
subclass of: CHEBI_76857
definition: An EC 1.3.1.* (oxidoreductase acting on donor CH-CH group, NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of enoyl-[acyl-carrier-protein] reductase (NADH), EC 1.3.1.9.
database_cross_reference: Wikipedia:Enoyl-acyl_carrier_protein_reductase
has OBO namespace: chebi_ontology
has related synonym: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitors
has related synonym: EC 1.3.1.9 inhibitor
has related synonym: EC 1.3.1.9 inhibitors
has related synonym: ENR inhibitor
has related synonym: ENR inhibitors
has related synonym: NADH-enoyl acyl carrier protein reductase inhibitor
has related synonym: NADH-enoyl acyl carrier protein reductase inhibitors
has related synonym: NADH-specific enoyl-ACP reductase inhibitor
has related synonym: NADH-specific enoyl-ACP reductase inhibitors
has related synonym: acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitor
has related synonym: acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitors
has related synonym: enoyl-ACP reductase inhibitor
has related synonym: enoyl-ACP reductase inhibitors
has related synonym: enoyl-[acyl carrier protein] reductase inhibitor
has related synonym: enoyl-[acyl carrier protein] reductase inhibitors
id: CHEBI:139512
in subset: 3 STAR

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.3.1.9 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 1.3.1.9 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: ENR inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: ENR inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: NADH-enoyl acyl carrier protein reductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: NADH-enoyl acyl carrier protein reductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: NADH-specific enoyl-ACP reductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: NADH-specific enoyl-ACP reductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: acyl-[acyl-carrier-protein]:NAD+ oxidoreductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: enoyl-ACP reductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: enoyl-ACP reductase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: enoyl-[acyl carrier protein] reductase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor
annotated property: hasRelatedSynonym
annotated target: enoyl-[acyl carrier protein] reductase inhibitors
database_cross_reference: ChEBI

alpha-hydroxy ketone
type: Class
subclass of: CHEBI_30879
subclass of: CHEBI_52396
definition: An alpha-oxyketone that has a hydroxy group as the alpha-oxy moiety.
database_cross_reference: PMID:15326516
database_cross_reference: PMID:19908854
database_cross_reference: PMID:20382022
database_cross_reference: PMID:23295224
has OBO namespace: chebi_ontology
has related synonym: alpha-hydroxy ketones
has related synonym: alpha-hydroxy-ketone
has related synonym: alpha-hydroxy-ketones
has related synonym: alpha-hydroxyketone
has related synonym: alpha-hydroxyketones
id: CHEBI:139588
in subset: 3 STAR

Axiom
annotated source: alpha-hydroxy ketone
annotated property: database_cross_reference
annotated target: PMID:15326516
source: Europe PMC

Axiom
annotated source: alpha-hydroxy ketone
annotated property: database_cross_reference
annotated target: PMID:19908854
source: Europe PMC

Axiom
annotated source: alpha-hydroxy ketone
annotated property: database_cross_reference
annotated target: PMID:20382022
source: Europe PMC

Axiom
annotated source: alpha-hydroxy ketone
annotated property: database_cross_reference
annotated target: PMID:23295224
source: Europe PMC

Axiom
annotated source: alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxy ketones
database_cross_reference: ChEBI

Axiom
annotated source: alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxy-ketone
database_cross_reference: ChEBI

Axiom
annotated source: alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxy-ketones
database_cross_reference: ChEBI

Axiom
annotated source: alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxyketone
database_cross_reference: ChEBI

Axiom
annotated source: alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: alpha-hydroxyketones
database_cross_reference: ChEBI

retinoid anion
type: Class
subclass of: CHEBI_29067
definition: A carboxylic acid anion obtained by deprotonation of any retinoid carboxy group.
has OBO namespace: chebi_ontology
has related synonym: retinoate
has related synonym: retinoates
has related synonym: retinoid anions
has related synonym: retinoid carboxylate anion
has related synonym: retinoid carboxylate anions
has related synonym: retinoid carboxylic acid anion
has related synonym: retinoid carboxylic acid anions
id: CHEBI:139589
in subset: 3 STAR

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoate
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoates
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoid anions
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoid carboxylate anion
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoid carboxylate anions
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoid carboxylic acid anion
database_cross_reference: ChEBI

Axiom
annotated source: retinoid anion
annotated property: hasRelatedSynonym
annotated target: retinoid carboxylic acid anions
database_cross_reference: ChEBI

primary alpha-hydroxy ketone
type: Class
subclass of: alpha-hydroxy ketone
subclass of: CHEBI_15734
definition: An alpha-hydroxy ketone in which the carbonyl group and the hydroxy group are linked by a -CH2 (methylene) group.
charge: 0
formula: C2H3O2R
mass: 59.044
monoisotopicmass: 59.01330
smiles: *C(C(O)([H])[H])=O
has OBO namespace: chebi_ontology
has related synonym: primary alpha-hydroxy ketones
has related synonym: primary alpha-hydroxy-ketone
has related synonym: primary alpha-hydroxy-ketones
has related synonym: primary alpha-hydroxyketone
has related synonym: primary alpha-hydroxyketones
id: CHEBI:139590
in subset: 3 STAR

Axiom
annotated source: primary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: primary alpha-hydroxy ketones
database_cross_reference: ChEBI

Axiom
annotated source: primary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: primary alpha-hydroxy-ketone
database_cross_reference: ChEBI

Axiom
annotated source: primary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: primary alpha-hydroxy-ketones
database_cross_reference: ChEBI

Axiom
annotated source: primary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: primary alpha-hydroxyketone
database_cross_reference: ChEBI

Axiom
annotated source: primary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: primary alpha-hydroxyketones
database_cross_reference: ChEBI

tertiary alpha-hydroxy ketone
type: Class
subclass of: alpha-hydroxy ketone
subclass of: CHEBI_26878
definition: An alpha-hydroxy ketone in which the carbonyl group and the hydroxy group are linked by a carbon bearing two organyl groups.
charge: 0
formula: C2HO2R3
mass: 57.028
monoisotopicmass: 56.99765
smiles: C(C(=O)*)(O)(*)*
has OBO namespace: chebi_ontology
has related synonym: tertiary alpha-hydroxy ketones
has related synonym: tertiary alpha-hydroxy-ketone
has related synonym: tertiary alpha-hydroxy-ketones
has related synonym: tertiary alpha-hydroxyketone
has related synonym: tertiary alpha-hydroxyketones
id: CHEBI:139592
in subset: 3 STAR

Axiom
annotated source: tertiary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: tertiary alpha-hydroxy ketones
database_cross_reference: ChEBI

Axiom
annotated source: tertiary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: tertiary alpha-hydroxy-ketone
database_cross_reference: ChEBI

Axiom
annotated source: tertiary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: tertiary alpha-hydroxy-ketones
database_cross_reference: ChEBI

Axiom
annotated source: tertiary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: tertiary alpha-hydroxyketone
database_cross_reference: ChEBI

Axiom
annotated source: tertiary alpha-hydroxy ketone
annotated property: hasRelatedSynonym
annotated target: tertiary alpha-hydroxyketones
database_cross_reference: ChEBI

phenyl acetates
type: Class
subclass of: CHEBI_22712
subclass of: CHEBI_47622
definition: An acetate ester obtained by formal condensation of the carboxy group of acetic acid with the hydroxy group of any phenol.
charge: 0
formula: C8H3O2R5
mass: 131.109
monoisotopicmass: 131.01330
smiles: C1(=C(C(=C(C(=C1*)*)*)*)*)OC(=O)C
database_cross_reference: MetaCyc:Phenyl-Acetates
has OBO namespace: chebi_ontology
has related synonym: a phenyl acetate
has related synonym: phenyl acetate derivative
has related synonym: phenyl acetate derivatives
id: CHEBI:140310
in subset: 3 STAR

Axiom
annotated source: phenyl acetates
annotated property: hasRelatedSynonym
annotated target: a phenyl acetate
database_cross_reference: UniProt

Axiom
annotated source: phenyl acetates
annotated property: hasRelatedSynonym
annotated target: phenyl acetate derivative
database_cross_reference: ChEBI

Axiom
annotated source: phenyl acetates
annotated property: hasRelatedSynonym
annotated target: phenyl acetate derivatives
database_cross_reference: ChEBI

triketone
type: Class
subclass of: CHEBI_17087
definition: A compound that contains three ketone functionalities.
has OBO namespace: chebi_ontology
has related synonym: triketones
id: CHEBI:140322
in subset: 3 STAR

Axiom
annotated source: triketone
annotated property: hasRelatedSynonym
annotated target: triketones
database_cross_reference: ChEBI

beta-triketone
type: Class
subclass of: triketone
definition: A triketone in which the each ketone functionality is located beta- to the other two.
has OBO namespace: chebi_ontology
has related synonym: beta-triketones
id: CHEBI:140323
in subset: 3 STAR

Axiom
annotated source: beta-triketone
annotated property: hasRelatedSynonym
annotated target: beta-triketones
database_cross_reference: ChEBI

primary carboxamide
type: Class
subclass of: CHEBI_37622
definition: A carboxamide resulting from the formal condensation of a carboxylic acid with ammonia; formula RC(=O)NH2.
charge: 0
formula: CH2NOR
mass: 44.033
monoisotopicmass: 44.01364
smiles: N(C(*)=O)([H])[H]
has OBO namespace: chebi_ontology
has related synonym: primary carboxamides
id: CHEBI:140324
in subset: 3 STAR

Axiom
annotated source: primary carboxamide
annotated property: hasRelatedSynonym
annotated target: primary carboxamides
database_cross_reference: ChEBI

secondary carboxamide
type: Class
subclass of: CHEBI_37622
definition: A carboxamide resulting from the formal condensation of a carboxylic acid with a primary amine; formula RC(=O)NHR(1).
charge: 0
formula: CHNOR2
mass: 43.025
monoisotopicmass: 43.00581
smiles: N(C(*)=O)(*)[H]
has OBO namespace: chebi_ontology
has related synonym: secondary carboxamides
id: CHEBI:140325
in subset: 3 STAR

Axiom
annotated source: secondary carboxamide
annotated property: hasRelatedSynonym
annotated target: secondary carboxamides
database_cross_reference: ChEBI

tertiary carboxamide
type: Class
subclass of: CHEBI_37622
definition: A carboxamide resulting from the formal condensation of a carboxylic acid with a secondary amine; formula RC(=O)NHR(1)R(2).
charge: 0
formula: CNOR3
mass: 42.017
monoisotopicmass: 41.99799
smiles: N(C(*)=O)(*)*
has OBO namespace: chebi_ontology
has related synonym: tertiary carboxamides
id: CHEBI:140326
in subset: 3 STAR

Axiom
annotated source: tertiary carboxamide
annotated property: hasRelatedSynonym
annotated target: tertiary carboxamides
database_cross_reference: ChEBI

hydroxy polyunsaturated fatty acid
type: Class
subclass of: CHEBI_24654
subclass of: CHEBI_26208
subclass of: Restriction
  on property: is conjugate acid of
  some values from: hydroxy polyunsaturated fatty acid anion
definition: Any polyunsaturated fatty acid carrying one or more hydroxy substituents.
has OBO namespace: chebi_ontology
id: CHEBI:140345
in subset: 3 STAR

2,4,6-trichlorophenolate
type: Class
subclass of: CHEBI_50525
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_28755
definition: A phenolate anion resulting from the deprotonation of the phenolic hydroxy group of 2,4,6-trichlorophenol.
charge: -1
formula: C6H2Cl3O
inchi: InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H/p-1
inchikey: LINPIYWFGCPVIE-UHFFFAOYSA-M
mass: 196.439
monoisotopicmass: 194.91767
smiles: C=1C(=C(C(=CC1Cl)Cl)[O-])Cl
database_cross_reference: MetaCyc:TRICHLOROPHENOL
database_cross_reference: PMID:8680829
has exact synonym: 2,4,6-trichlorophenolate
has OBO namespace: chebi_ontology
has related synonym: 2,4,6-trichlorophenol
id: CHEBI:140426
in subset: 3 STAR

Axiom
annotated source: 2,4,6-trichlorophenolate
annotated property: database_cross_reference
annotated target: PMID:8680829
source: Europe PMC

Axiom
annotated source: 2,4,6-trichlorophenolate
annotated property: has exact synonym
annotated target: 2,4,6-trichlorophenolate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2,4,6-trichlorophenolate
annotated property: hasRelatedSynonym
annotated target: 2,4,6-trichlorophenol
database_cross_reference: UniProt

tropomyosin-related kinase B receptor agonist
type: Class
subclass of: CHEBI_48705
definition: An agonist that binds to and deactivates the tropomyosin-related kinase B (TrkB) receptor, the main signaling receptor of the neurotrophin brain-derived neurotrophic factor (BDNF).
database_cross_reference: Wikipedia:Tropomyosin_receptor_kinase_B
has OBO namespace: chebi_ontology
has related synonym: TrkB receptor agonist
has related synonym: TrkB receptor agonists
has related synonym: tropomyosin-related kinase B receptor agonists
id: CHEBI:140489
in subset: 3 STAR

Axiom
annotated source: tropomyosin-related kinase B receptor agonist
annotated property: hasRelatedSynonym
annotated target: TrkB receptor agonist
database_cross_reference: ChEBI

Axiom
annotated source: tropomyosin-related kinase B receptor agonist
annotated property: hasRelatedSynonym
annotated target: TrkB receptor agonists
database_cross_reference: ChEBI

Axiom
annotated source: tropomyosin-related kinase B receptor agonist
annotated property: hasRelatedSynonym
annotated target: tropomyosin-related kinase B receptor agonists
database_cross_reference: ChEBI

kaolin
type: Class
subclass of: CHEBI_48730
subclass of: CHEBI_60004

fatty acid 4:0
type: Class
subclass of: CHEBI_26666
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_78115
definition: Any saturated fatty acid containing 4 carbons.
charge: 0
formula: CHO2R
mass: 45.017
monoisotopicmass: 44.99765
smiles: *C(O)=O
has OBO namespace: chebi_ontology
id: CHEBI:140601
in subset: 3 STAR

glioma-associated oncogene inhibitor
type: Class
subclass of: CHEBI_35222
definition: An inhibitor of any of the glioma-associated oncogene (GLI) proteins.
has OBO namespace: chebi_ontology
has related synonym: GLI inhibitor
has related synonym: GLI inhibitors
has related synonym: glioma-associated oncogene inhibitors
id: CHEBI:140922
in subset: 3 STAR

Axiom
annotated source: glioma-associated oncogene inhibitor
annotated property: hasRelatedSynonym
annotated target: GLI inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: glioma-associated oncogene inhibitor
annotated property: hasRelatedSynonym
annotated target: GLI inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: glioma-associated oncogene inhibitor
annotated property: hasRelatedSynonym
annotated target: glioma-associated oncogene inhibitors
database_cross_reference: ChEBI

fatty acid 18:2
type: Class
subclass of: CHEBI_35366
charge: 0
formula: C18H32O2
mass: 280.452
monoisotopicmass: 280.24023
smiles: C(=O)(O)*
has OBO namespace: chebi_ontology
has related synonym: FA 18:2
has related synonym: FA(18:2)
id: CHEBI:140949
in subset: 2 STAR

Axiom
annotated source: fatty acid 18:2
annotated property: hasRelatedSynonym
annotated target: FA 18:2
database_cross_reference: ChEBI

Axiom
annotated source: fatty acid 18:2
annotated property: hasRelatedSynonym
annotated target: FA(18:2)
database_cross_reference: ChEBI

quinone outside inhibitor
type: Class
subclass of: CHEBI_24127
subclass of: CHEBI_38499
definition: A mitochondrial cytochrome-bc1 complex inhibitor that acts at the Quinone 'outer' (Qo) binding site of the cytochrome-bc1 complex.
database_cross_reference: Wikipedia:QoI
has OBO namespace: chebi_ontology
has related synonym: QOI
has related synonym: QOIs
has related synonym: Qo inhibitor
has related synonym: Qo inhibitors
has related synonym: quinone outside inhibitors
id: CHEBI:141153
in subset: 3 STAR

Axiom
annotated source: quinone outside inhibitor
annotated property: hasRelatedSynonym
annotated target: QOI
database_cross_reference: ChEBI

Axiom
annotated source: quinone outside inhibitor
annotated property: hasRelatedSynonym
annotated target: QOIs
database_cross_reference: ChEBI

Axiom
annotated source: quinone outside inhibitor
annotated property: hasRelatedSynonym
annotated target: Qo inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: quinone outside inhibitor
annotated property: hasRelatedSynonym
annotated target: Qo inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: quinone outside inhibitor
annotated property: hasRelatedSynonym
annotated target: quinone outside inhibitors
database_cross_reference: ChEBI

pinoxaden acid
type: Class
subclass of: pyrazolooxadiazepine
subclass of: CHEBI_22712
subclass of: CHEBI_33822
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24527
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33286
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_70722
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78298
definition: An organic hydroxy compound resulting from the hydrolysis of the the pivalate ester group of the proherbicide pinoxaden.
charge: 0
formula: C18H24N2O3
inchi: InChI=1S/C18H24N2O3/c1-4-13-10-12(3)11-14(5-2)15(13)16-17(21)19-6-8-23-9-7-20(19)18(16)22/h10-11,21H,4-9H2,1-3H3
inchikey: YWZBGRYDSPLRHR-UHFFFAOYSA-N
mass: 316.395
monoisotopicmass: 316.17869
database_cross_reference: Reaxys:31687354
has exact synonym: 8-(2,6-diethyl-4-methylphenyl)-9-hydroxy-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-7-one
has OBO namespace: chebi_ontology
id: CHEBI:141347
in subset: 3 STAR

Axiom
annotated source: pinoxaden acid
annotated property: database_cross_reference
annotated target: Reaxys:31687354
source: Reaxys

Axiom
annotated source: pinoxaden acid
annotated property: has exact synonym
annotated target: 8-(2,6-diethyl-4-methylphenyl)-9-hydroxy-1,2,4,5-tetrahydro-7H-pyrazolo[1,2-d][1,4,5]oxadiazepin-7-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

3,6-dichloro-2-methoxybenzoate
type: Class
subclass of: CHEBI_22718
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_59128
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_81856
definition: A member of the class of benzoates resuting from the deprotonation of the carboxy group of 3,6-dichloro-2-methoxybenzoic acid (dicamba). Major microspecies at pH 7.3
charge: -1
formula: C8H5Cl2O3
inchi: InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)/p-1
inchikey: IWEDIXLBFLAXBO-UHFFFAOYSA-M
mass: 220.030
monoisotopicmass: 218.96212
smiles: C1(=CC=C(C(=C1OC)C([O-])=O)Cl)Cl
database_cross_reference: MetaCyc:CPD-11248
has exact synonym: 3,6-dichloro-2-methoxybenzoate
has OBO namespace: chebi_ontology
has related synonym: dicamba(1-)
id: CHEBI:141349
in subset: 3 STAR

Axiom
annotated source: 3,6-dichloro-2-methoxybenzoate
annotated property: has exact synonym
annotated target: 3,6-dichloro-2-methoxybenzoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 3,6-dichloro-2-methoxybenzoate
annotated property: has exact synonym
annotated target: 3,6-dichloro-2-methoxybenzoate
database_cross_reference: UniProt

Axiom
annotated source: 3,6-dichloro-2-methoxybenzoate
annotated property: hasRelatedSynonym
annotated target: dicamba(1-)
database_cross_reference: ChEBI

diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
type: Class
subclass of: CHEBI_23990
subclass of: CHEBI_37512
subclass of: CHEBI_51307
definition: A diester that is diethyl succinate in which position 2 is substituted by a (dimethoxyphosphorothioyl)thio group.
charge: 0
formula: C10H19O6PS2
inchi: InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3
inchikey: JXSJBGJIGXNWCI-UHFFFAOYSA-N
mass: 330.361
monoisotopicmass: 330.03607
smiles: C(C(OCC)=O)C(C(OCC)=O)SP(OC)(OC)=S
database_cross_reference: Reaxys:5381514
has exact synonym: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
has OBO namespace: chebi_ontology
id: CHEBI:141474
in subset: 3 STAR

Axiom
annotated source: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
annotated property: database_cross_reference
annotated target: Reaxys:5381514
source: Reaxys

Axiom
annotated source: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
annotated property: has exact synonym
annotated target: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

(R)-malathion
type: Class
subclass of: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-malathion
definition: A diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate that is the R-enantiomer of malathion.
charge: 0
formula: C10H19O6PS2
inchi: InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3/t8-/m1/s1
inchikey: JXSJBGJIGXNWCI-MRVPVSSYSA-N
mass: 330.361
monoisotopicmass: 330.03607
smiles: C(C(OCC)=O)[C@H](C(OCC)=O)SP(OC)(OC)=S
has exact synonym: diethyl (2R)-2-[(dimethoxyphosphorothioyl)thio]succinate
has OBO namespace: chebi_ontology
has related synonym: (R)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate
id: CHEBI:141475
in subset: 3 STAR

Axiom
annotated source: (R)-malathion
annotated property: has exact synonym
annotated target: diethyl (2R)-2-[(dimethoxyphosphorothioyl)thio]succinate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R)-malathion
annotated property: hasRelatedSynonym
annotated target: (R)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate
database_cross_reference: ChEBI

(S)-malathion
type: Class
subclass of: diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate
subclass of: Restriction
  on property: is enantiomer of
  some values from: (R)-malathion
definition: A diethyl 2-[(dimethoxyphosphorothioyl)thio]succinate that is the S-enantiomer of malathion.
charge: 0
formula: C10H19O6PS2
inchi: InChI=1S/C10H19O6PS2/c1-5-15-9(11)7-8(10(12)16-6-2)19-17(18,13-3)14-4/h8H,5-7H2,1-4H3/t8-/m0/s1
inchikey: JXSJBGJIGXNWCI-QMMMGPOBSA-N
mass: 330.361
monoisotopicmass: 330.03607
smiles: C(C(OCC)=O)[C@@H](C(OCC)=O)SP(OC)(OC)=S
database_cross_reference: Reaxys:5381515
has exact synonym: diethyl (2S)-2-[(dimethoxyphosphorothioyl)thio]succinate
has OBO namespace: chebi_ontology
has related synonym: (S)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate
id: CHEBI:141476
in subset: 3 STAR

Axiom
annotated source: (S)-malathion
annotated property: database_cross_reference
annotated target: Reaxys:5381515
source: Reaxys

Axiom
annotated source: (S)-malathion
annotated property: has exact synonym
annotated target: diethyl (2S)-2-[(dimethoxyphosphorothioyl)thio]succinate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-malathion
annotated property: hasRelatedSynonym
annotated target: (S)-O-[1,2-bis-(ethoxycarbonyl)ethyl]-O,O-dimethyl phosphorodithioate
database_cross_reference: ChEBI

carboxybiphenyl
type: Class
subclass of: CHEBI_22723
subclass of: CHEBI_22888
definition: Any member of the class of biphenyls that has one or more carboxy groups attached to the biphenyl skeleton.
has OBO namespace: chebi_ontology
has related synonym: carboxybiphenyls
id: CHEBI:141493
in subset: 3 STAR

Axiom
annotated source: carboxybiphenyl
annotated property: hasRelatedSynonym
annotated target: carboxybiphenyls
database_cross_reference: ChEBI

hemiaminal ether
type: Class
subclass of: CHEBI_36963
subclass of: CHEBI_50047
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_73080
definition: An organic amino compound that is a hemiaminal in which the hydrogen atom of the hydroxy group has been replaced by an organyl group. General formula: R2C(OR')NR2 ( R =/= H ). Also known as alpha-amino ethers.
charge: 0
formula: CNOR5
mass: 42.017
monoisotopicmass: 41.99799
smiles: N(C(O*)(*)*)(*)*
has OBO namespace: chebi_ontology
has related synonym: alpha-amino ether
has related synonym: alpha-amino ethers
has related synonym: hemiaminal ethers
id: CHEBI:141498
in subset: 3 STAR

Axiom
annotated source: hemiaminal ether
annotated property: hasRelatedSynonym
annotated target: alpha-amino ether
database_cross_reference: ChEBI

Axiom
annotated source: hemiaminal ether
annotated property: hasRelatedSynonym
annotated target: alpha-amino ethers
database_cross_reference: ChEBI

Axiom
annotated source: hemiaminal ether
annotated property: hasRelatedSynonym
annotated target: hemiaminal ethers
database_cross_reference: ChEBI

L-tyrosinal(1+)
type: Class
subclass of: CHEBI_65296
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_46209
definition: A primary ammonium ion resulting from the protonation of the amino group of L-tyrosinal.
charge: +1
formula: C9H12NO2
inchi: InChI=1S/C9H11NO2/c10-8(6-11)5-7-1-3-9(12)4-2-7/h1-4,6,8,12H,5,10H2/p+1/t8-/m0/s1
inchikey: DXGAIOIQACHYRK-QMMMGPOBSA-O
mass: 166.197
monoisotopicmass: 166.08626
smiles: O=C[C@@H]([NH3+])CC=1C=CC(=CC1)O
database_cross_reference: MetaCyc:CPD-21526
database_cross_reference: PMID:23281040
has exact synonym: (2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-aminium
has OBO namespace: chebi_ontology
has related synonym: (2S)-1-(p-hydroxyphenyl)-3-oxopropan-2-aminium
has related synonym: L-tyrosinal
id: CHEBI:141668
in subset: 3 STAR

Axiom
annotated source: L-tyrosinal(1+)
annotated property: database_cross_reference
annotated target: PMID:23281040
source: SUBMITTER

Axiom
annotated source: L-tyrosinal(1+)
annotated property: has exact synonym
annotated target: (2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-aminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: L-tyrosinal(1+)
annotated property: hasRelatedSynonym
annotated target: (2S)-1-(p-hydroxyphenyl)-3-oxopropan-2-aminium
database_cross_reference: ChEBI

Axiom
annotated source: L-tyrosinal(1+)
annotated property: hasRelatedSynonym
annotated target: L-tyrosinal
database_cross_reference: UniProt

hexahydronaphthalenes
type: Class
subclass of: CHEBI_36785
definition: Any carbobycyclic compound that is an hexahydronaphthalene or a compound obtained from an hexahydronaphthalene by formal substitution of one or more hydrogens.
has OBO namespace: chebi_ontology
id: CHEBI:142348
in subset: 3 STAR

purines D-ribonucleoside
type: Class
subclass of: CHEBI_26399
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_26386
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_47013
definition: A purine ribonucleoside that is a purine derivative attached to a beta-D-ribofuranosyl residue at position 9 via a glycosidic (N-glycosyl) linkage.
charge: 0
formula: C10H11N4O4R2
mass: 251.219
monoisotopicmass: 251.07803
has OBO namespace: chebi_ontology
has related synonym: a purine D-ribonucleoside
id: CHEBI:142355
in subset: 3 STAR

Axiom
annotated source: purines D-ribonucleoside
annotated property: hasRelatedSynonym
annotated target: a purine D-ribonucleoside
database_cross_reference: UniProt

1,2-dichloropropane
type: Class
subclass of: volatile organic compound
subclass of: CHEBI_23128
definition: A chloroalkane that is propane in which a hydrogen from each of two adjacent carbons has been replaced by chlorines.
charge: 0
formula: C3H6Cl2
inchi: InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3
inchikey: KNKRKFALVUDBJE-UHFFFAOYSA-N
mass: 112.986
monoisotopicmass: 111.98466
smiles: CC(CCl)Cl
database_cross_reference: Reaxys:1718880
has OBO namespace: chebi_ontology
id: CHEBI:142468
in subset: 3 STAR

Axiom
annotated source: 1,2-dichloropropane
annotated property: database_cross_reference
annotated target: Reaxys:1718880
source: Reaxys

(R)-1,2-dichloropropane
type: Class
subclass of: 1,2-dichloropropane
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-1,2-dichloropropane
definition: A 1,2-dichloropropane that has R configuration.
charge: 0
formula: C3H6Cl2
inchi: InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3/t3-/m1/s1
inchikey: KNKRKFALVUDBJE-GSVOUGTGSA-N
mass: 112.986
monoisotopicmass: 111.98466
smiles: C[C@H](CCl)Cl
database_cross_reference: PMID:28527381
database_cross_reference: Reaxys:1718882
has exact synonym: (2R)-1,2-dichloropropane
has OBO namespace: chebi_ontology
has related synonym: (2R)-dichloro-1,2 propane
has related synonym: (R)-1,2-DCP
has related synonym: (R)-alpha,beta-dichloropropane
has related synonym: (R)-alpha,beta-propylene dichloride
has related synonym: (R)-propylene dichloride
id: CHEBI:142469
in subset: 3 STAR

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: database_cross_reference
annotated target: PMID:28527381
source: Europe PMC

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: database_cross_reference
annotated target: Reaxys:1718882
source: Reaxys

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: has exact synonym
annotated target: (2R)-1,2-dichloropropane
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (2R)-dichloro-1,2 propane
database_cross_reference: ChEBI

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (R)-1,2-DCP
database_cross_reference: ChEBI

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (R)-alpha,beta-dichloropropane
database_cross_reference: ChEBI

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (R)-alpha,beta-propylene dichloride
database_cross_reference: ChEBI

Axiom
annotated source: (R)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (R)-propylene dichloride
database_cross_reference: ChEBI

(S)-1,2-dichloropropane
type: Class
subclass of: 1,2-dichloropropane
subclass of: Restriction
  on property: is enantiomer of
  some values from: (R)-1,2-dichloropropane
definition: A 1,2-dichloropropane that has S configuration.
charge: 0
formula: C3H6Cl2
inchi: InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3/t3-/m0/s1
inchikey: KNKRKFALVUDBJE-VKHMYHEASA-N
mass: 112.986
monoisotopicmass: 111.98466
smiles: C[C@@H](CCl)Cl
database_cross_reference: PMID:28527381
database_cross_reference: Reaxys:1718881
has exact synonym: (2S)-1,2-dichloropropane
has OBO namespace: chebi_ontology
has related synonym: (2S)-1,2-DCP
has related synonym: (2S)-alpha,beta-dichloropropane
has related synonym: (2S)-alpha,beta-propylene dichloride
has related synonym: (2S)-propylene dichloride
id: CHEBI:142471
in subset: 3 STAR

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: database_cross_reference
annotated target: PMID:28527381
source: Europe PMC

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: database_cross_reference
annotated target: Reaxys:1718881
source: Reaxys

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: has exact synonym
annotated target: (2S)-1,2-dichloropropane
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (2S)-1,2-DCP
database_cross_reference: ChEBI

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (2S)-alpha,beta-dichloropropane
database_cross_reference: ChEBI

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (2S)-alpha,beta-propylene dichloride
database_cross_reference: ChEBI

Axiom
annotated source: (S)-1,2-dichloropropane
annotated property: hasRelatedSynonym
annotated target: (2S)-propylene dichloride
database_cross_reference: ChEBI

oxime anion
type: Class
subclass of: CHEBI_25696
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_25750
definition: A organic ion resulting from the deprotonation of the hydroxy group of any oxime.
charge: -1
formula: CNO
mass: 42.017
monoisotopicmass: 41.99799
smiles: C(*)(=N[O-])*
has exact synonym: oxime anion
has OBO namespace: chebi_ontology
has related synonym: oximate
has related synonym: oximates
has related synonym: oxime anions
id: CHEBI:142513
in subset: 3 STAR

Axiom
annotated source: oxime anion
annotated property: has exact synonym
annotated target: oxime anion
database_cross_reference: ChEBI

Axiom
annotated source: oxime anion
annotated property: hasRelatedSynonym
annotated target: oximate
database_cross_reference: ChEBI

Axiom
annotated source: oxime anion
annotated property: hasRelatedSynonym
annotated target: oximates
database_cross_reference: ChEBI

Axiom
annotated source: oxime anion
annotated property: hasRelatedSynonym
annotated target: oxime anions
database_cross_reference: ChEBI

tamsulosin(1+)
type: Class
subclass of: secondary ammonium ion
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI 9398
subclass of: Restriction
  on property: is enantiomer of
  some values from: ent-tamsulosin(1+)
definition: A secondary ammonium ion resulting from the protonation of the secondary amino group of tamsulosin. The major species at pH 7.3.
charge: +1
formula: C20H29N2O5S
inchi: InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)/p+1/t15-/m1/s1
inchikey: DRHKJLXJIQTDTD-OAHLLOKOSA-O
mass: 409.522
monoisotopicmass: 409.17917
has exact synonym: (2R)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium
has OBO namespace: chebi_ontology
id: CHEBI:142544
in subset: 3 STAR

Axiom
annotated source: tamsulosin(1+)
annotated property: has exact synonym
annotated target: (2R)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
type: Class
subclass of: CHEBI_35358
subclass of: CHEBI_35618
subclass of: CHEBI_50995
definition: A secondary amino compound that is ammonia in which nitrogen is substituted by a 1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl group and a 2-(2-ethoxyphenoxy)ethyl group.
charge: 0
formula: C20H28N2O5S
inchi: InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)
inchikey: DRHKJLXJIQTDTD-UHFFFAOYSA-N
mass: 408.514
monoisotopicmass: 408.17189
database_cross_reference: PMID:2891044
has exact synonym: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
has OBO namespace: chebi_ontology
has related synonym: 5-(2-{[2-(o-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
id: CHEBI:142546
in subset: 3 STAR

Axiom
annotated source: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
annotated property: database_cross_reference
annotated target: PMID:2891044
source: Europe PMC

Axiom
annotated source: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
annotated property: has exact synonym
annotated target: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
annotated property: hasRelatedSynonym
annotated target: 5-(2-{[2-(o-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
database_cross_reference: ChEBI

ent-tamsulosin
type: Class
subclass of: 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide
subclass of: Restriction
  on property: is conjugate base of
  some values from: ent-tamsulosin(1+)
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI 9398
definition: A 5-(2-{[2-(2-ethoxyphenoxy)ethyl]amino}propyl)-2-methoxybenzenesulfonamide that has (S)-configuration. The enantiomer of tamsulosin.
charge: 0
formula: C20H28N2O5S
inchi: InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)/t15-/m0/s1
inchikey: DRHKJLXJIQTDTD-HNNXBMFYSA-N
mass: 408.514
monoisotopicmass: 408.17189
database_cross_reference: CAS:106138-88-9
database_cross_reference: PMID:2891044
database_cross_reference: Reaxys:6896058
has OBO namespace: chebi_ontology
has related synonym: (+)-tamsulosin
has related synonym: (S)-(+)-tamsulosin
has related synonym: (S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide
has related synonym: (S)-tamsulosin
id: CHEBI:142548
in subset: 3 STAR

Axiom
annotated source: ent-tamsulosin
annotated property: database_cross_reference
annotated target: CAS:106138-88-9
source: ChemIDplus

Axiom
annotated source: ent-tamsulosin
annotated property: database_cross_reference
annotated target: PMID:2891044
source: Europe PMC

Axiom
annotated source: ent-tamsulosin
annotated property: database_cross_reference
annotated target: Reaxys:6896058
source: Reaxys

Axiom
annotated source: ent-tamsulosin
annotated property: hasRelatedSynonym
annotated target: (+)-tamsulosin
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin
annotated property: hasRelatedSynonym
annotated target: (S)-(+)-tamsulosin
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin
annotated property: hasRelatedSynonym
annotated target: (S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin
annotated property: hasRelatedSynonym
annotated target: (S)-tamsulosin
database_cross_reference: ChemIDplus

ent-tamsulosin(1+)
type: Class
subclass of: secondary ammonium ion
subclass of: Restriction
  on property: is conjugate acid of
  some values from: ent-tamsulosin
subclass of: Restriction
  on property: is enantiomer of
  some values from: tamsulosin(1+)
definition: A secondary ammonium ion resulting from the secondary amino group of ent-tamsulosin. The major species at pH 7.3.
charge: +1
formula: C20H29N2O5S
inchi: InChI=1S/C20H28N2O5S/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24)/p+1/t15-/m0/s1
inchikey: DRHKJLXJIQTDTD-HNNXBMFYSA-O
mass: 409.522
monoisotopicmass: 409.17917
has exact synonym: (2S)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium
has OBO namespace: chebi_ontology
has related synonym: (+)-tamsulosin(1+)
has related synonym: (S)-(+)-tamsulosin(1+)
has related synonym: (S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide(1+)
has related synonym: (S)-tamsulosin(1+)
id: CHEBI:142549
in subset: 3 STAR

Axiom
annotated source: ent-tamsulosin(1+)
annotated property: has exact synonym
annotated target: (2S)-N-[2-(2-ethoxyphenoxy)ethyl]-1-(4-methoxy-3-sulfamoylphenyl)propan-2-aminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: ent-tamsulosin(1+)
annotated property: hasRelatedSynonym
annotated target: (+)-tamsulosin(1+)
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin(1+)
annotated property: hasRelatedSynonym
annotated target: (S)-(+)-tamsulosin(1+)
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin(1+)
annotated property: hasRelatedSynonym
annotated target: (S)-5-(2-((2-(2-ethoxyphenoxy)ethyl)amino)propyl)-2-methoxybenzenesulfonamide(1+)
database_cross_reference: ChEBI

Axiom
annotated source: ent-tamsulosin(1+)
annotated property: hasRelatedSynonym
annotated target: (S)-tamsulosin(1+)
database_cross_reference: ChEBI

primary fatty alcohol
type: Class
subclass of: CHEBI_15734
subclass of: CHEBI_24026
definition: Any fatty alcohol in which the hydroxy group is attached to a methylene (CH2) group.
charge: 0
formula: CH3OR
mass: 31.034
monoisotopicmass: 31.01839
smiles: *CO
has exact synonym: primary fatty alcohol
has OBO namespace: chebi_ontology
has related synonym: a primary fatty alcohol
has related synonym: primary fatty alcohols
id: CHEBI:142622
in subset: 3 STAR

Axiom
annotated source: primary fatty alcohol
annotated property: has exact synonym
annotated target: primary fatty alcohol
database_cross_reference: ChEBI

Axiom
annotated source: primary fatty alcohol
annotated property: hasRelatedSynonym
annotated target: a primary fatty alcohol
database_cross_reference: UniProt

Axiom
annotated source: primary fatty alcohol
annotated property: hasRelatedSynonym
annotated target: primary fatty alcohols
database_cross_reference: ChEBI

asulam(1-)
type: Class
subclass of: CHEBI_50335
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_81696
definition: An organic nitrogen anion resulting from the deprotonation of the N-acylsulfonamide moiety of asulam. The conjugate base of asulam.
charge: -1
formula: C8H9N2O4S
inchi: InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)/p-1
inchikey: VGPYEHKOIGNJKV-UHFFFAOYSA-M
mass: 229.234
monoisotopicmass: 229.02885
smiles: C1=C(C=CC(=C1)S([N-]C(OC)=O)(=O)=O)N
has OBO namespace: chebi_ontology
has related synonym: asulam anion
has related synonym: methyl sulfanilylcarbamate(1-)
id: CHEBI:142669
in subset: 3 STAR

Axiom
annotated source: asulam(1-)
annotated property: has exact synonym
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: asulam(1-)
annotated property: has exact synonym
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: asulam(1-)
annotated property: hasRelatedSynonym
annotated target: asulam anion
database_cross_reference: ChEBI

Axiom
annotated source: asulam(1-)
annotated property: hasRelatedSynonym
annotated target: methyl sulfanilylcarbamate(1-)
database_cross_reference: ChEBI

TRPV channel modulator
type: Class
subclass of: TRP channel modulator
definition: Any transient receptor potential (TRP) channel modulator that modulates the TRPV channels (V = vanilloid). There is strong evidence that action at one or more of this class of proteins is responsible for the insecticidal action of pymetrozine, pyrifluquinazon, and afidopyropen.
has OBO namespace: chebi_ontology
has related synonym: TRPV channel modulators
has related synonym: transient receptor potential (vanilloid) channel modulator
has related synonym: transient receptor potential (vanilloid) channel modulators
id: CHEBI:142782
in subset: 3 STAR

Axiom
annotated source: TRPV channel modulator
annotated property: hasRelatedSynonym
annotated target: TRPV channel modulators
database_cross_reference: ChEBI

Axiom
annotated source: TRPV channel modulator
annotated property: hasRelatedSynonym
annotated target: transient receptor potential (vanilloid) channel modulator
database_cross_reference: ChEBI

Axiom
annotated source: TRPV channel modulator
annotated property: hasRelatedSynonym
annotated target: transient receptor potential (vanilloid) channel modulators
database_cross_reference: ChEBI

TRP channel modulator
type: Class
subclass of: CHEBI_38632
definition: An agent that modulates the passage of cations through the transient receptor potential (TRP) channels.
has OBO namespace: chebi_ontology
has related synonym: TRP channel modulators
id: CHEBI:142783
in subset: 3 STAR

Axiom
annotated source: TRP channel modulator
annotated property: hasRelatedSynonym
annotated target: TRP channel modulators
database_cross_reference: ChEBI

enolate
type: Class
subclass of: CHEBI_25696
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_33823
definition: An organic anion arising from deprotonation of the hydroxy group of an enol.
charge: -1
formula: C2OR3
mass: 40.021
monoisotopicmass: 39.99491
smiles: [O-]C(=C(*)*)*
has OBO namespace: chebi_ontology
has related synonym: enolate anion
has related synonym: enolate anions
has related synonym: enolates
id: CHEBI:142839
in subset: 3 STAR

Axiom
annotated source: enolate
annotated property: hasRelatedSynonym
annotated target: enolate anion
database_cross_reference: ChEBI

Axiom
annotated source: enolate
annotated property: hasRelatedSynonym
annotated target: enolate anions
database_cross_reference: ChEBI

Axiom
annotated source: enolate
annotated property: hasRelatedSynonym
annotated target: enolates
database_cross_reference: ChEBI

D-homoserine zwitterion
type: Class
subclass of: CHEBI_59871
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_30654
definition: A D-alpha-amino acid zwitterion arising from transfer of a proton from the carboxy to the amino group of D-homoserine; major species at pH 7.3.
charge: 0
formula: C4H9NO3
inchi: InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m1/s1
inchikey: UKAUYVFTDYCKQA-GSVOUGTGSA-N
mass: 119.119
monoisotopicmass: 119.05824
smiles: C([C@H](C([O-])=O)[NH3+])CO
database_cross_reference: MetaCyc:CPD-12255
database_cross_reference: PMID:24419381
has exact synonym: (2R)-2-azaniumyl-4-hydroxybutanoate
has OBO namespace: chebi_ontology
has related synonym: D-homoserine
id: CHEBI:143081
in subset: 3 STAR

Axiom
annotated source: D-homoserine zwitterion
annotated property: database_cross_reference
annotated target: PMID:24419381
source: SUBMITTER

Axiom
annotated source: D-homoserine zwitterion
annotated property: has exact synonym
annotated target: (2R)-2-azaniumyl-4-hydroxybutanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: D-homoserine zwitterion
annotated property: hasRelatedSynonym
annotated target: D-homoserine
database_cross_reference: UniProt

organometalloidal compound
type: Class
subclass of: CHEBI_50860
definition: A compound having bonds between one or more metalloid atoms and one or more carbon atoms of an organyl group.
database_cross_reference: PMID:15246002
database_cross_reference: PMID:17741021
database_cross_reference: PMID:8403081
database_cross_reference: PMID:908316
has OBO namespace: chebi_ontology
has related synonym: organometalloidal
has related synonym: organometalloidal compounds
has related synonym: organometalloidals
id: CHEBI:143084
in subset: 3 STAR

Axiom
annotated source: organometalloidal compound
annotated property: database_cross_reference
annotated target: PMID:15246002
source: Europe PMC

Axiom
annotated source: organometalloidal compound
annotated property: database_cross_reference
annotated target: PMID:17741021
source: Europe PMC

Axiom
annotated source: organometalloidal compound
annotated property: database_cross_reference
annotated target: PMID:8403081
source: Europe PMC

Axiom
annotated source: organometalloidal compound
annotated property: database_cross_reference
annotated target: PMID:908316
source: Europe PMC

Axiom
annotated source: organometalloidal compound
annotated property: hasRelatedSynonym
annotated target: organometalloidal
database_cross_reference: ChEBI

Axiom
annotated source: organometalloidal compound
annotated property: hasRelatedSynonym
annotated target: organometalloidal compounds
database_cross_reference: ChEBI

Axiom
annotated source: organometalloidal compound
annotated property: hasRelatedSynonym
annotated target: organometalloidals
database_cross_reference: ChEBI

glutamate(1-)
type: Class
subclass of: CHEBI_33558
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78675
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_29987
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_18237
definition: An alpha-amino-acid anion that is the conjugate base of glutamic acid, having anionic carboxy groups and a cationic amino group
charge: -1
formula: C5H8NO4
inchi: InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/p-1
inchikey: WHUUTDBJXJRKMK-UHFFFAOYSA-M
mass: 146.12136
monoisotopicmass: 146.04588
smiles: [NH3+]C(CCC([O-])=O)C([O-])=O
database_cross_reference: Gmelin:327908
has exact synonym: glutamate(1-)
has exact synonym: hydrogen glutamate
has OBO namespace: chebi_ontology
has related synonym: 2-ammoniopentanedioate
has related synonym: glutamate
has related synonym: glutamic acid monoanion
id: CHEBI:14321
in subset: 3 STAR

Axiom
annotated source: glutamate(1-)
annotated property: database_cross_reference
annotated target: Gmelin:327908
source: Gmelin

Axiom
annotated source: glutamate(1-)
annotated property: has exact synonym
annotated target: glutamate(1-)
database_cross_reference: JCBN

Axiom
annotated source: glutamate(1-)
annotated property: has exact synonym
annotated target: hydrogen glutamate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: glutamate(1-)
annotated property: hasRelatedSynonym
annotated target: 2-ammoniopentanedioate
database_cross_reference: IUPAC

Axiom
annotated source: glutamate(1-)
annotated property: hasRelatedSynonym
annotated target: glutamate
database_cross_reference: UniProt

Axiom
annotated source: glutamate(1-)
annotated property: hasRelatedSynonym
annotated target: glutamic acid monoanion
database_cross_reference: JCBN

indole-3-butyrate
type: Class
subclass of: CHEBI_38468
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_33070
definition: An indol-3-yl carboxylic acid anion that is the conjugate base of indole-3-butyric acid, arising from the deprotonation of the carboxy group.
charge: -1
formula: C12H12NO2
inchi: InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)/p-1
inchikey: JTEDVYBZBROSJT-UHFFFAOYSA-M
mass: 202.234
monoisotopicmass: 202.08735
smiles: C=1C=CC=C2NC=C(C12)CCCC([O-])=O
database_cross_reference: Chemspider:2934315
database_cross_reference: MetaCyc:CPD-10507
has exact synonym: 4-(1H-indol-3-yl)butanoate
has exact synonym: indole-3-butyrate
has OBO namespace: chebi_ontology
has related synonym: (indol-3-yl)butanoate
has related synonym: 1H-indole-3-butanoate
has related synonym: 1H-indole-3-butyrate
has related synonym: 3-indolebutyrate
has related synonym: 4-(indol-3-yl)butanoate
has related synonym: indole-3-butanoate
has related synonym: indole-3-butyric acid(1-)
id: CHEBI:143274
in subset: 3 STAR

Axiom
annotated source: indole-3-butyrate
annotated property: database_cross_reference
annotated target: Chemspider:2934315
source: SUBMITTER

Axiom
annotated source: indole-3-butyrate
annotated property: has exact synonym
annotated target: 4-(1H-indol-3-yl)butanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: indole-3-butyrate
annotated property: has exact synonym
annotated target: indole-3-butyrate
database_cross_reference: MetaCyc

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: (indol-3-yl)butanoate
database_cross_reference: UniProt

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: 1H-indole-3-butanoate
database_cross_reference: ChEBI

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: 1H-indole-3-butyrate
database_cross_reference: ChEBI

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: 3-indolebutyrate
database_cross_reference: ChEBI

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: 4-(indol-3-yl)butanoate
database_cross_reference: MetaCyc

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: indole-3-butanoate
database_cross_reference: MetaCyc

Axiom
annotated source: indole-3-butyrate
annotated property: hasRelatedSynonym
annotated target: indole-3-butyric acid(1-)
database_cross_reference: ChEBI

4-(2,4-dichlorophenoxy)butanoate
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24527
subclass of: Restriction
  on property: has role
  some values from: CHEBI_26841
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33286
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_73173
definition: A monocarboxylic acid anion resulting from the dprotonation of the carboxy group of 4-(2,4-dichlorophenoxy)butanoic acid (2,4-DB). The major species at pH 7.3.
charge: -1
formula: C10H9Cl2O3
inchi: InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)/p-1
inchikey: YIVXMZJTEQBPQO-UHFFFAOYSA-M
mass: 248.080
monoisotopicmass: 246.99342
smiles: C=1C=C(C=C(C1OCCCC([O-])=O)Cl)Cl
database_cross_reference: PMID:12801099
database_cross_reference: PMID:19435093
has exact synonym: 4-(2,4-dichlorophenoxy)butanoate
has OBO namespace: chebi_ontology
has related synonym: 2,4-DB(1-)
has related synonym: 4-(2,4-dichlorophenoxy)butyrate
id: CHEBI:143277
in subset: 3 STAR

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: database_cross_reference
annotated target: PMID:12801099
source: Europe PMC

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: database_cross_reference
annotated target: PMID:19435093
source: Europe PMC

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: has exact synonym
annotated target: 4-(2,4-dichlorophenoxy)butanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: has exact synonym
annotated target: 4-(2,4-dichlorophenoxy)butanoate
database_cross_reference: UniProt

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: hasRelatedSynonym
annotated target: 2,4-DB(1-)
database_cross_reference: ChEBI

Axiom
annotated source: 4-(2,4-dichlorophenoxy)butanoate
annotated property: hasRelatedSynonym
annotated target: 4-(2,4-dichlorophenoxy)butyrate
database_cross_reference: ChEBI

pentanol
type: Class
subclass of: volatile organic compound
subclass of: CHEBI_50584
subclass of: Restriction
  on property: has parent hydride
  some values from: CHEBI_37830
definition: A fatty alcohol consisting of a hydroxy function at any position of an unbranched saturated chain of five carbon atoms.
has OBO namespace: chebi_ontology
id: CHEBI:143597
in subset: 3 STAR

(R,R)-chrysanthemol
type: Class
subclass of: CHEBI_81217
definition: A chrysanthemol in which both chiral centres have R configuration.
charge: 0
formula: C10H18O
inchi: InChI=1S/C10H18O/c1-7(2)5-8-9(6-11)10(8,3)4/h5,8-9,11H,6H2,1-4H3/t8-,9-/m1/s1
inchikey: HIPIENNKVJCMAP-RKDXNWHRSA-N
mass: 154.253
monoisotopicmass: 154.13577
smiles: C1([C@@H]([C@H]1C=C(C)C)CO)(C)C
database_cross_reference: PMID:25378387
has exact synonym: (R,R)-chrysanthemol
has exact synonym: [(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanol
has OBO namespace: chebi_ontology
id: CHEBI:143898
in subset: 3 STAR

Axiom
annotated source: (R,R)-chrysanthemol
annotated property: database_cross_reference
annotated target: PMID:25378387
source: SUBMITTER

Axiom
annotated source: (R,R)-chrysanthemol
annotated property: has exact synonym
annotated target: (R,R)-chrysanthemol
database_cross_reference: UniProt

Axiom
annotated source: (R,R)-chrysanthemol
annotated property: has exact synonym
annotated target: [(1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropyl]methanol
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

(R,R)-chrysanthemal
type: Class
subclass of: CHEBI_25409
subclass of: CHEBI_51454
subclass of: CHEBI_59768
subclass of: CHEBI_78840
subclass of: Restriction
  on property: has functional parent
  some values from: (R,R)-chrysanthemol
definition: An aldehyde resulting from the formal oxidation of the hydroxy group of (R,R)-chrysanthemol.
charge: 0
formula: C10H16O
inchi: InChI=1S/C10H16O/c1-7(2)5-8-9(6-11)10(8,3)4/h5-6,8-9H,1-4H3/t8-,9-/m1/s1
inchikey: NQLKPDBZZUIQGM-RKDXNWHRSA-N
mass: 152.237
monoisotopicmass: 152.12012
smiles: C1([C@@H]([C@H]1C=C(C)C)C=O)(C)C
database_cross_reference: PMID:29122986
has exact synonym: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarbaldehyde
has OBO namespace: chebi_ontology
has related synonym: (1R,3R)-chrysanthemal
id: CHEBI:143899
in subset: 3 STAR

Axiom
annotated source: (R,R)-chrysanthemal
annotated property: database_cross_reference
annotated target: PMID:29122986
source: SUBMITTER

Axiom
annotated source: (R,R)-chrysanthemal
annotated property: has exact synonym
annotated target: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarbaldehyde
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R,R)-chrysanthemal
annotated property: hasRelatedSynonym
annotated target: (1R,3R)-chrysanthemal
database_cross_reference: ChEBI

Axiom
annotated source: (R,R)-chrysanthemal
annotated property: hasRelatedSynonym
annotated target: (1R,3R)-chrysanthemal
database_cross_reference: UniProt

(R,R)-chrysanthemate
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_39100
definition: A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of (+)-trans-chrysanthemic acid. The major species at pH 7.3.
charge: -1
formula: C10H15O2
inchi: InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)/p-1/t7-,8+/m1/s1
inchikey: XLOPRKKSAJMMEW-SFYZADRCSA-M
mass: 167.229
monoisotopicmass: 167.10775
smiles: C1([C@@H]([C@H]1C=C(C)C)C([O-])=O)(C)C
database_cross_reference: MetaCyc:CPD-13662
database_cross_reference: PMID:29122986
has exact synonym: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate
has OBO namespace: chebi_ontology
has related synonym: (+)-trans-chrysanthemate
has related synonym: (1R)-trans-chrysanthemate
has related synonym: (1R,3R)-chrysanthemate
id: CHEBI:143900
in subset: 3 STAR

Axiom
annotated source: (R,R)-chrysanthemate
annotated property: database_cross_reference
annotated target: PMID:29122986
source: SUBMITTER

Axiom
annotated source: (R,R)-chrysanthemate
annotated property: has exact synonym
annotated target: (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R,R)-chrysanthemate
annotated property: hasRelatedSynonym
annotated target: (+)-trans-chrysanthemate
database_cross_reference: ChEBI

Axiom
annotated source: (R,R)-chrysanthemate
annotated property: hasRelatedSynonym
annotated target: (1R)-trans-chrysanthemate
database_cross_reference: MetaCyc

Axiom
annotated source: (R,R)-chrysanthemate
annotated property: hasRelatedSynonym
annotated target: (1R,3R)-chrysanthemate
database_cross_reference: UniProt

N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
type: Class
subclass of: CHEBI_18379
subclass of: CHEBI_26878
subclass of: CHEBI_29347
subclass of: CHEBI_35850
subclass of: CHEBI_83565
subclass of: CHEBI_83575
definition: A member of the class of (trifluoromethyl)benzenes that is 4-amino-2-(trifluoromethyl)benzonitrile in which one of the amino hydrogens is substituted by a 3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanoyl group.
charge: 0
formula: C18H14F4N2O4S
inchikey: LKJPYSCBVHEWIU-UHFFFAOYSA-N
mass: 430.370
monoisotopicmass: 430.06104
has exact synonym: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
has OBO namespace: chebi_ontology
id: CHEBI:144093
in subset: 3 STAR

Axiom
annotated source: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
annotated property: has exact synonym
annotated target: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

(S)-bicalutamide
type: Class
subclass of: N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_39589
definition: A N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide that is the (S)-enantiomer of bicalutamide.
charge: 0
formula: C18H14F4N2O4S
inchikey: LKJPYSCBVHEWIU-QGZVFWFLSA-N
mass: 430.370
monoisotopicmass: 430.06104
database_cross_reference: CAS:113299-38-0
database_cross_reference: PDBeChem:0U9
database_cross_reference: PMID:15509184
database_cross_reference: PMID:23288837
database_cross_reference: PMID:23527766
has exact synonym: (2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
has OBO namespace: chebi_ontology
has related synonym: (+)-bicalutamide
has related synonym: (S)-Casodex
id: CHEBI:144094
in subset: 3 STAR

Axiom
annotated source: (S)-bicalutamide
annotated property: database_cross_reference
annotated target: CAS:113299-38-0
source: ChemIDplus

Axiom
annotated source: (S)-bicalutamide
annotated property: database_cross_reference
annotated target: PMID:15509184
source: Europe PMC

Axiom
annotated source: (S)-bicalutamide
annotated property: database_cross_reference
annotated target: PMID:23288837
source: Europe PMC

Axiom
annotated source: (S)-bicalutamide
annotated property: database_cross_reference
annotated target: PMID:23527766
source: Europe PMC

Axiom
annotated source: (S)-bicalutamide
annotated property: has exact synonym
annotated target: (2S)-N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-hydroxy-2-methylpropanamide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-bicalutamide
annotated property: hasRelatedSynonym
annotated target: (+)-bicalutamide
database_cross_reference: ChemIDplus

Axiom
annotated source: (S)-bicalutamide
annotated property: hasRelatedSynonym
annotated target: (S)-Casodex
database_cross_reference: ChemIDplus

a tetracycline zwitterion
type: Class
subclass of: CHEBI_26895
charge: 0
formula: C21H17N2O7R5
mass: 409.370
monoisotopicmass: 409.10358
has OBO namespace: chebi_ontology
has related synonym: a tetracycline
id: CHEBI:144644
in subset: 2 STAR

Axiom
annotated source: a tetracycline zwitterion
annotated property: hasRelatedSynonym
annotated target: a tetracycline
database_cross_reference: UniProt

antispermatogenic agent
type: Class
subclass of: CHEBI_33232
definition: An agent that destroy spermatozoa in the male genitalia and block spermatogenesis.
database_cross_reference: PMID:16371305
has OBO namespace: chebi_ontology
has related synonym: antispermatogenic
has related synonym: antispermatogenic agents
has related synonym: antispermatogenics
id: CHEBI:145047
in subset: 3 STAR

Axiom
annotated source: antispermatogenic agent
annotated property: database_cross_reference
annotated target: PMID:16371305
source: Europe PMC

Axiom
annotated source: antispermatogenic agent
annotated property: hasRelatedSynonym
annotated target: antispermatogenic
database_cross_reference: ChEBI

Axiom
annotated source: antispermatogenic agent
annotated property: hasRelatedSynonym
annotated target: antispermatogenic agents
database_cross_reference: ChEBI

Axiom
annotated source: antispermatogenic agent
annotated property: hasRelatedSynonym
annotated target: antispermatogenics
database_cross_reference: ChEBI

(R)-diclofop
type: Class
subclass of: 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
subclass of: Restriction
  on property: has role
  some values from: CHEBI_60575
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-diclofop
definition: A 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid that is the (R)-enantiomer of diclofop.
charge: 0
formula: C15H12Cl2O4
inchi: InChI=1S/C15H12Cl2O4/c1-9(15(18)19)20-11-3-5-12(6-4-11)21-14-7-2-10(16)8-13(14)17/h2-9H,1H3,(H,18,19)/t9-/m1/s1
inchikey: OOLBCHYXZDXLDS-SECBINFHSA-N
mass: 327.160
monoisotopicmass: 326.01126
has alternative id: CHEBI:47365
database_cross_reference: CAS:71283-28-8
database_cross_reference: DrugBank:DB03781
database_cross_reference: PDBeChem:D1L
database_cross_reference: PMID:23857454
database_cross_reference: PMID:24240105
database_cross_reference: PMID:28884187
has exact synonym: (2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
has OBO namespace: chebi_ontology
has related synonym: (+)-diclofop
has related synonym: [R,(+)]-2-[4-(2,4-dichlorophenoxy)phenoxy]propionic acid
id: CHEBI:145403
in subset: 3 STAR

Axiom
annotated source: (R)-diclofop
annotated property: database_cross_reference
annotated target: CAS:71283-28-8
source: ChEBI

Axiom
annotated source: (R)-diclofop
annotated property: database_cross_reference
annotated target: PMID:23857454
source: Europe PMC

Axiom
annotated source: (R)-diclofop
annotated property: database_cross_reference
annotated target: PMID:24240105
source: Europe PMC

Axiom
annotated source: (R)-diclofop
annotated property: database_cross_reference
annotated target: PMID:28884187
source: Europe PMC

Axiom
annotated source: (R)-diclofop
annotated property: has exact synonym
annotated target: (2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (R)-diclofop
annotated property: hasRelatedSynonym
annotated target: (+)-diclofop
database_cross_reference: ChEBI

Axiom
annotated source: (R)-diclofop
annotated property: hasRelatedSynonym
annotated target: [R,(+)]-2-[4-(2,4-dichlorophenoxy)phenoxy]propionic acid
database_cross_reference: ChEBI

(S)-diclofop
type: Class
subclass of: 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
subclass of: Restriction
  on property: is enantiomer of
  some values from: (R)-diclofop
definition: A 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid that is the (S)-enantiomer of diclofop.
charge: 0
formula: C15H12Cl2O4
inchi: InChI=1S/C15H12Cl2O4/c1-9(15(18)19)20-11-3-5-12(6-4-11)21-14-7-2-10(16)8-13(14)17/h2-9H,1H3,(H,18,19)/t9-/m0/s1
inchikey: OOLBCHYXZDXLDS-VIFPVBQESA-N
mass: 327.160
monoisotopicmass: 326.01126
database_cross_reference: CAS:75021-71-5
database_cross_reference: PMID:23857454
database_cross_reference: PMID:26501920
has exact synonym: (2S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
has OBO namespace: chebi_ontology
has related synonym: (-)-diclofop
has related synonym: (S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
id: CHEBI:145404
in subset: 3 STAR

Axiom
annotated source: (S)-diclofop
annotated property: database_cross_reference
annotated target: CAS:75021-71-5
source: ChEBI

Axiom
annotated source: (S)-diclofop
annotated property: database_cross_reference
annotated target: PMID:23857454
source: Europe PMC

Axiom
annotated source: (S)-diclofop
annotated property: database_cross_reference
annotated target: PMID:26501920
source: Europe PMC

Axiom
annotated source: (S)-diclofop
annotated property: has exact synonym
annotated target: (2S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-diclofop
annotated property: hasRelatedSynonym
annotated target: (-)-diclofop
database_cross_reference: ChEBI

Axiom
annotated source: (S)-diclofop
annotated property: hasRelatedSynonym
annotated target: (S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
database_cross_reference: ChEBI

2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
type: Class
subclass of: CHEBI_23697
subclass of: CHEBI_25384
subclass of: CHEBI_35618
subclass of: CHEBI_46786
definition: An aromatic ether that is 2-(4-hydroxyphenoxy)propanoic acid in which the hydrogen of the hydroxy group at position 4 has been substituted by a 2,4-dichlorophenyl group.
charge: 0
formula: C15H12Cl2O4
inchi: InChI=1S/C15H12Cl2O4/c1-9(15(18)19)20-11-3-5-12(6-4-11)21-14-7-2-10(16)8-13(14)17/h2-9H,1H3,(H,18,19)
inchikey: OOLBCHYXZDXLDS-UHFFFAOYSA-N
mass: 327.160
monoisotopicmass: 326.01126
has exact synonym: 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
has OBO namespace: chebi_ontology
id: CHEBI:145406
in subset: 3 STAR

Axiom
annotated source: 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
annotated property: has exact synonym
annotated target: 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
type: Class
subclass of: CHEBI_23697
subclass of: CHEBI_25248
subclass of: CHEBI_35618
subclass of: CHEBI_46786
definition: A methyl ester resulting from the formal condensation of the carboxylic acid group of 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid with methanol.
charge: 0
formula: C16H14Cl2O4
inchi: InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3
inchikey: BACHBFVBHLGWSL-UHFFFAOYSA-N
mass: 341.180
monoisotopicmass: 340.02691
has exact synonym: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
has OBO namespace: chebi_ontology
id: CHEBI:145412
in subset: 3 STAR

Axiom
annotated source: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
annotated property: has exact synonym
annotated target: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

(R)-diclofop-methyl
type: Class
subclass of: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
subclass of: Restriction
  on property: is enantiomer of
  some values from: (S)-diclofop-methyl
definition: A methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate that is the (R)-enantiomer of diclofop-methyl.
charge: 0
formula: C16H14Cl2O4
inchi: InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3/t10-/m1/s1
inchikey: BACHBFVBHLGWSL-SNVBAGLBSA-N
mass: 341.180
monoisotopicmass: 340.02691
database_cross_reference: AGR:IND44326446
database_cross_reference: CAS:71283-65-3
database_cross_reference: PMID:26501920
has exact synonym: methyl (2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
has OBO namespace: chebi_ontology
id: CHEBI:145413
in subset: 3 STAR

Axiom
annotated source: (R)-diclofop-methyl
annotated property: database_cross_reference
annotated target: AGR:IND44326446
source: Europe PMC

Axiom
annotated source: (R)-diclofop-methyl
annotated property: database_cross_reference
annotated target: CAS:71283-65-3
source: ChemIDplus

Axiom
annotated source: (R)-diclofop-methyl
annotated property: database_cross_reference
annotated target: PMID:26501920
source: Europe PMC

Axiom
annotated source: (R)-diclofop-methyl
annotated property: has exact synonym
annotated target: methyl (2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

(S)-diclofop-methyl
type: Class
subclass of: methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
subclass of: Restriction
  on property: is enantiomer of
  some values from: (R)-diclofop-methyl
definition: A methyl 2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate that is the (S)-enantiomer of diclofop-methyl.
charge: 0
formula: C16H14Cl2O4
inchi: InChI=1S/C16H14Cl2O4/c1-10(16(19)20-2)21-12-4-6-13(7-5-12)22-15-8-3-11(17)9-14(15)18/h3-10H,1-2H3/t10-/m0/s1
inchikey: BACHBFVBHLGWSL-JTQLQIEISA-N
mass: 341.180
monoisotopicmass: 340.02691
database_cross_reference: AGR:IND44326446
database_cross_reference: CAS:75021-72-6
database_cross_reference: PMID:26501920
has exact synonym: methyl (2S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
has OBO namespace: chebi_ontology
id: CHEBI:145414
in subset: 3 STAR

Axiom
annotated source: (S)-diclofop-methyl
annotated property: database_cross_reference
annotated target: AGR:IND44326446
source: Europe PMC

Axiom
annotated source: (S)-diclofop-methyl
annotated property: database_cross_reference
annotated target: CAS:75021-72-6
source: ChemIDplus

Axiom
annotated source: (S)-diclofop-methyl
annotated property: database_cross_reference
annotated target: PMID:26501920
source: Europe PMC

Axiom
annotated source: (S)-diclofop-methyl
annotated property: has exact synonym
annotated target: methyl (2S)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

macropolylide
type: Class
subclass of: CHEBI_25106
definition: Macrolides (macrocyclic lactones) in which the macrocyclic ring contains more than one ester linkage. Macropolylides include macrodiolides, macrotriolides, macrotetrolides and macropentolides, each containing di-, tri-, tetra-, and penta- ester linkages, respectively, in one macrocyclic ring. Macrocyclic lactones containing nitrogen in their skeletons (azamacrolides and macrolide lactams) and also containing oxazole or thiazole in their skeletons are known in nature.
has OBO namespace: chebi_ontology
has related synonym: macropolylides
id: CHEBI:145555
in subset: 3 STAR

Axiom
annotated source: macropolylide
annotated property: hasRelatedSynonym
annotated target: macropolylides
database_cross_reference: ChEBI

macrodiolide
type: Class
subclass of: macropolylide
definition: A macropolylide which contains two ester linkages in one macrocyclic ring.
database_cross_reference: PMID:17446696
database_cross_reference: PMID:29624065
database_cross_reference: PMID:29671776
database_cross_reference: PMID:31247219
has OBO namespace: chebi_ontology
has related synonym: macrodiolides
id: CHEBI:145556
in subset: 3 STAR

Axiom
annotated source: macrodiolide
annotated property: database_cross_reference
annotated target: PMID:17446696
source: Europe PMC

Axiom
annotated source: macrodiolide
annotated property: database_cross_reference
annotated target: PMID:29624065
source: Europe PMC

Axiom
annotated source: macrodiolide
annotated property: database_cross_reference
annotated target: PMID:29671776
source: Europe PMC

Axiom
annotated source: macrodiolide
annotated property: database_cross_reference
annotated target: PMID:31247219
source: Europe PMC

Axiom
annotated source: macrodiolide
annotated property: hasRelatedSynonym
annotated target: macrodiolides
database_cross_reference: ChEBI

macrolide lactam
type: Class
subclass of: CHEBI_24995
subclass of: CHEBI_25106
definition: A macrolide in which the macrocyclic lactone ring includes an amide group.
database_cross_reference: PMID:11678663
database_cross_reference: PMID:12227772
database_cross_reference: PMID:15248618
database_cross_reference: PMID:17378533
database_cross_reference: PMID:31226284
has OBO namespace: chebi_ontology
has related synonym: macrolide lactams
id: CHEBI:145565
in subset: 3 STAR

Axiom
annotated source: macrolide lactam
annotated property: database_cross_reference
annotated target: PMID:11678663
source: Europe PMC

Axiom
annotated source: macrolide lactam
annotated property: database_cross_reference
annotated target: PMID:12227772
source: Europe PMC

Axiom
annotated source: macrolide lactam
annotated property: database_cross_reference
annotated target: PMID:15248618
source: Europe PMC

Axiom
annotated source: macrolide lactam
annotated property: database_cross_reference
annotated target: PMID:17378533
source: Europe PMC

Axiom
annotated source: macrolide lactam
annotated property: database_cross_reference
annotated target: PMID:31226284
source: Europe PMC

Axiom
annotated source: macrolide lactam
annotated property: hasRelatedSynonym
annotated target: macrolide lactams
database_cross_reference: ChEBI

(S)-2-methylbutanoate
type: Class
subclass of: CHEBI_58951
subclass of: CHEBI_58956
subclass of: CHEBI_83976
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_38655
definition: A branched-chain saturated fatty acid anion resulting from the deprotonation of the carboxy group of (S)-2-methylbutanoic acid. The major species at pH 7.3.
charge: -1
formula: C5H9O2
inchi: InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)/p-1/t4-/m0/s1
inchikey: WLAMNBDJUVNPJU-BYPYZUCNSA-M
mass: 101.126
monoisotopicmass: 101.06080
smiles: [O-]C([C@H](CC)C)=O
database_cross_reference: PMID:16819884
has exact synonym: (2S)-2-methylbutanoate
has exact synonym: (S)-2-methylbutanoate
has OBO namespace: chebi_ontology
has related synonym: (2S)-2-methylbutyrate
has related synonym: (2S)-2-methylbutyric acid anion
has related synonym: (S)-2-methylbutyrate
has related synonym: (S)-alpha-methylbutyrate
id: CHEBI:145932
in subset: 3 STAR

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: database_cross_reference
annotated target: PMID:16819884
source: Europe PMC

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: has exact synonym
annotated target: (2S)-2-methylbutanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: has exact synonym
annotated target: (S)-2-methylbutanoate
database_cross_reference: UniProt

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: hasRelatedSynonym
annotated target: (2S)-2-methylbutyrate
database_cross_reference: ChEBI

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: hasRelatedSynonym
annotated target: (2S)-2-methylbutyric acid anion
database_cross_reference: ChEBI

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: hasRelatedSynonym
annotated target: (S)-2-methylbutyrate
database_cross_reference: ChEBI

Axiom
annotated source: (S)-2-methylbutanoate
annotated property: hasRelatedSynonym
annotated target: (S)-alpha-methylbutyrate
database_cross_reference: ChEBI

levomethorphan
type: Class
subclass of: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35482
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50266
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI 6444
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI 4470
definition: A 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene in which the stereocenters at positions 4a, 10 and 10a have R-configuration. It is a prodrug of levorphanol and a strong narcotic analgesic, and listed as a schedule II controlled substance.
charge: 0
formula: C18H25NO
inchi: InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m0/s1
inchikey: MKXZASYAUGDDCJ-CGTJXYLNSA-N
mass: 271.404
monoisotopicmass: 271.19361
database_cross_reference: CAS:125-70-2
database_cross_reference: PMID:16870378
database_cross_reference: PMID:26226106
database_cross_reference: PMID:28867701
database_cross_reference: PMID:29131506
database_cross_reference: Wikipedia:Levomethorphan
has exact synonym: (4aR,10R,10aR)-6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
has exact synonym: 3-methoxy-17-methylmorphinan
has OBO namespace: chebi_ontology
has related synonym: (-)-3-methoxy-17-methylmorphinan
has related synonym: (-)-3-methoxy-N-methylmorphinan
has related synonym: L-3-methoxy-17-methylmorphinan
has related synonym: L-methorphan
has related synonym: levomethorphan
has related synonym: levomethorphane
has related synonym: levomethorphanum
has related synonym: levometorfano
id: CHEBI:146176
in subset: 3 STAR

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: CAS:125-70-2
source: ChemIDplus

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: CAS:125-70-2
source: NIST Chemistry WebBook

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: PMID:16870378
source: Europe PMC

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: PMID:26226106
source: Europe PMC

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: PMID:28867701
source: Europe PMC

Axiom
annotated source: levomethorphan
annotated property: database_cross_reference
annotated target: PMID:29131506
source: Europe PMC

Axiom
annotated source: levomethorphan
annotated property: has exact synonym
annotated target: (4aR,10R,10aR)-6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: levomethorphan
annotated property: has exact synonym
annotated target: 3-methoxy-17-methylmorphinan
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: (-)-3-methoxy-17-methylmorphinan
database_cross_reference: ChEBI

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: (-)-3-methoxy-N-methylmorphinan
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: L-3-methoxy-17-methylmorphinan
database_cross_reference: ChEBI

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: L-methorphan
database_cross_reference: ChemIDplus

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: levomethorphan
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: levomethorphane
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: levomethorphanum
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: levomethorphan
annotated property: hasRelatedSynonym
annotated target: levometorfano
database_cross_reference: WHO_MedNet
has synonym type: INN

6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
type: Class
subclass of: CHEBI_25418
subclass of: CHEBI_35618
subclass of: CHEBI_38163
subclass of: CHEBI_83818
definition: An organic heterotetracyclic compound that is 1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene which is substituted by a methoxy group at position 6 and a methyl group at position 11.
charge: 0
formula: C18H25NO
inchi: InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3
inchikey: MKXZASYAUGDDCJ-UHFFFAOYSA-N
mass: 271.404
monoisotopicmass: 271.19361
has exact synonym: 4-methoxy-17-methyl-17-azatetracyclo[7.5.3.0(1,10).0(2,7)]heptadeca-2(7),3,5-triene
has exact synonym: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
has OBO namespace: chebi_ontology
id: CHEBI:146178
in subset: 3 STAR

Axiom
annotated source: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
annotated property: has exact synonym
annotated target: 4-methoxy-17-methyl-17-azatetracyclo[7.5.3.0(1,10).0(2,7)]heptadeca-2(7),3,5-triene
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
annotated property: has exact synonym
annotated target: 6-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthrene
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

oneirogen
type: Class
subclass of: CHEBI_35471
definition: Any substance that produces or enhances dream-like states of consciousness.
database_cross_reference: Wikipedia:Oneirogen
has OBO namespace: chebi_ontology
has related synonym: oneirogens
id: CHEBI:146270
in subset: 3 STAR

Axiom
annotated source: oneirogen
annotated property: hasRelatedSynonym
annotated target: oneirogens
database_cross_reference: ChEBI

11-HPETE(1-)
type: Class
subclass of: CHEBI_59720
charge: -1
formula: C20H31O4
inchi: InChI=1S/C20H32O4/c1-2-3-4-5-7-10-13-16-19(24-23)17-14-11-8-6-9-12-15-18-20(21)22/h6-7,9-11,13-14,16,19,23H,2-5,8,12,15,17-18H2,1H3,(H,21,22)/p-1/b9-6-,10-7-,14-11-,16-13+
inchikey: PCGWZQXAGFGRTQ-RLZWZWKOSA-M
mass: 335.465
monoisotopicmass: 335.22278
smiles: C(CCC/C=C\C/C=C\CC(/C=C/C=C\CCCCC)OO)(=O)[O-]
database_cross_reference: PMID:27435673
has OBO namespace: chebi_ontology
has related synonym: 11-hydroperoxy-(5Z,8Z,12E,14Z)-eicosatetraenoate
has related synonym: 11-hydroperoxy-(5Z,8Z,12E,14Z)-icosatetraenoate(1-)
id: CHEBI:146291
in subset: 2 STAR

Axiom
annotated source: 11-HPETE(1-)
annotated property: database_cross_reference
annotated target: PMID:27435673
source: SUBMITTER

Axiom
annotated source: 11-HPETE(1-)
annotated property: hasRelatedSynonym
annotated target: 11-hydroperoxy-(5Z,8Z,12E,14Z)-eicosatetraenoate
database_cross_reference: UniProt

Axiom
annotated source: 11-HPETE(1-)
annotated property: hasRelatedSynonym
annotated target: 11-hydroperoxy-(5Z,8Z,12E,14Z)-icosatetraenoate(1-)
database_cross_reference: SUBMITTER

9-HPODE(1-)
type: Class
subclass of: HPODE(1-)
charge: -1
formula: C18H31O4
inchi: InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/p-1/b8-6-,14-11+
inchikey: JGUNZIWGNMQSBM-ZJHFMPGASA-M
mass: 311.443
monoisotopicmass: 311.22278
smiles: C(CCCCCCCC(/C=C/C=C\CCCCC)OO)([O-])=O
database_cross_reference: PMID:27435673
has OBO namespace: chebi_ontology
has related synonym: 9-hydroperoxy-(10E,12Z)-octadecadienoate
has related synonym: 9-hydroperoxy-(10E,12Z)-octadecadienoate(1-)
id: CHEBI:146293
in subset: 2 STAR

Axiom
annotated source: 9-HPODE(1-)
annotated property: database_cross_reference
annotated target: PMID:27435673
source: SUBMITTER

Axiom
annotated source: 9-HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: 9-hydroperoxy-(10E,12Z)-octadecadienoate
database_cross_reference: UniProt

Axiom
annotated source: 9-HPODE(1-)
annotated property: hasRelatedSynonym
annotated target: 9-hydroperoxy-(10E,12Z)-octadecadienoate(1-)
database_cross_reference: SUBMITTER

EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
type: Class
subclass of: CHEBI_76796
definition: An EC 3.4.22.* (cysteine endopeptidase) inhibitor that interferes with the action of SARS coronavirus main proteinase (EC 3.4.22.69).
database_cross_reference: Wikipedia:C30_Endopeptidase
has OBO namespace: chebi_ontology
has related synonym: 3C-like protease inhibitor
has related synonym: 3C-like protease inhibitors
has related synonym: 3cLpro inhibitor
has related synonym: 3cLpro inhibitors
has related synonym: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitors
has related synonym: EC 3.4.22.69 inhibitor
has related synonym: EC 3.4.22.69 inhibitors
has related synonym: Mpro inhibitor
has related synonym: Mpro inhibitors
has related synonym: SARS 3C-like protease inhibitor
has related synonym: SARS 3C-like protease inhibitors
has related synonym: SARS coronavirus 3CL protease inhibitor
has related synonym: SARS coronavirus 3CL protease inhibitors
has related synonym: SARS coronavirus main peptidase inhibitor
has related synonym: SARS coronavirus main peptidase inhibitors
has related synonym: SARS coronavirus main protease inhibitor
has related synonym: SARS coronavirus main protease inhibitors
has related synonym: SARS coronavirus main proteinase inhibitor
has related synonym: SARS coronavirus main proteinase inhibitors
has related synonym: SARS-CoV 3CLpro enzyme inhibitor
has related synonym: SARS-CoV 3CLpro enzyme inhibitors
has related synonym: SARS-CoV Mpro inhibitor
has related synonym: SARS-CoV Mpro inhibitors
has related synonym: SARS-CoV main protease inhibitor
has related synonym: SARS-CoV main protease inhibitors
has related synonym: coronavirus 3C-like protease inhibitor
has related synonym: coronavirus 3C-like protease inhibitors
has related synonym: severe acute respiratory syndrome coronavirus main protease inhibitor
has related synonym: severe acute respiratory syndrome coronavirus main protease inhibitors
id: CHEBI:147285
in subset: 3 STAR

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 3C-like protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 3C-like protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 3cLpro inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: 3cLpro inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.4.22.69 inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: EC 3.4.22.69 inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Mpro inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: Mpro inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS 3C-like protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS 3C-like protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus 3CL protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus 3CL protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main peptidase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main peptidase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main proteinase inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS coronavirus main proteinase inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV 3CLpro enzyme inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV 3CLpro enzyme inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV Mpro inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV Mpro inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV main protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: SARS-CoV main protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: coronavirus 3C-like protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: coronavirus 3C-like protease inhibitors
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: severe acute respiratory syndrome coronavirus main protease inhibitor
database_cross_reference: ChEBI

Axiom
annotated source: EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor
annotated property: hasRelatedSynonym
annotated target: severe acute respiratory syndrome coronavirus main protease inhibitors
database_cross_reference: ChEBI

nitrification inhibitor
type: Class
subclass of: CHEBI_35222
definition: Any inhibitor added to nitrogen fertilizers which can reduce the rate at which ammonium is converted to nitrate. Under appropriate conditions, this can help reduce nitrogen losses through denitrification and leaching.
database_cross_reference: Wikipedia:Nitrification
has OBO namespace: chebi_ontology
has related synonym: nitrification inhibitors
id: CHEBI:148436
in subset: 3 STAR

Axiom
annotated source: nitrification inhibitor
annotated property: hasRelatedSynonym
annotated target: nitrification inhibitors
database_cross_reference: ChEBI

chloroquine(2+)
type: Class
subclass of: tertiary ammonium ion
subclass of: CHEBI_52837
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI 3638
definition: A quinolinium ion obtained by protonation of the quinoline nitrogen and tertiary amino group of the antimalarial drug chloroquine. It is the major species at pH 7.3.
charge: +2
formula: C18H28ClN3
inchi: InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)/p+2
inchikey: WHTVZRBIWZFKQO-UHFFFAOYSA-P
mass: 321.890
monoisotopicmass: 321.19608
smiles: [NH+]1=CC=C(C=2C1=CC(Cl)=CC2)NC(CCC[NH+](CC)CC)C
database_cross_reference: PMID:25693996
has exact synonym: 7-chloro-4-{[5-(diethylazaniumyl)pentan-2-yl]amino}quinolinium
has OBO namespace: chebi_ontology
has related synonym: chloroquine dication
has related synonym: di-protonated chloroquine
id: CHEBI:149484
in subset: 3 STAR

Axiom
annotated source: chloroquine(2+)
annotated property: database_cross_reference
annotated target: PMID:25693996
source: Europe PMC

Axiom
annotated source: chloroquine(2+)
annotated property: has exact synonym
annotated target: 7-chloro-4-{[5-(diethylazaniumyl)pentan-2-yl]amino}quinolinium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: chloroquine(2+)
annotated property: hasRelatedSynonym
annotated target: chloroquine dication
database_cross_reference: ChEBI

Axiom
annotated source: chloroquine(2+)
annotated property: hasRelatedSynonym
annotated target: di-protonated chloroquine
database_cross_reference: ChEBI

losartan(1-)
type: Class
subclass of: CHEBI_25696
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI 6541
definition: An organic anion that is the conjugate base of losartan, obtained from the deprotonation of the tetrazole NH group. Major species at pH 7.3.
charge: -1
formula: C22H22ClN6O
inchi: InChI=1S/C22H22ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3/q-1
inchikey: MDMTUGIZSFHDIC-UHFFFAOYSA-N
mass: 421.910
monoisotopicmass: 421.15491
database_cross_reference: PMID:18674515
has exact synonym: 5-(4'-{[2-butyl-4-chloro-5-(hydroxymethyl)-1H-imidazol-1-yl]methyl}[biphenyl]-2-yl)tetrazol-1-ide
has OBO namespace: chebi_ontology
has related synonym: losartan
id: CHEBI:149504
in subset: 3 STAR

Axiom
annotated source: losartan(1-)
annotated property: database_cross_reference
annotated target: PMID:18674515
source: SUBMITTER

Axiom
annotated source: losartan(1-)
annotated property: has exact synonym
annotated target: 5-(4'-{[2-butyl-4-chloro-5-(hydroxymethyl)-1H-imidazol-1-yl]methyl}[biphenyl]-2-yl)tetrazol-1-ide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: losartan(1-)
annotated property: hasRelatedSynonym
annotated target: losartan
database_cross_reference: UniProt

candesartan(2-)
type: Class
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI 3347
definition: A monocarboxylic acid anion resulting from the deprotonation of the tetrazole NH group and carboxy group of candesartan. It is the major species at pH 7.3.
charge: -2
formula: C24H18N6O3
inchi: InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H2,26,27,28,29,31,32)/p-2
inchikey: BSLSLQSFLOCXQQ-UHFFFAOYSA-L
mass: 438.448
monoisotopicmass: 438.14514
smiles: C1(=CC=C(C=C1)CN2C3=C(C(=O)[O-])C=CC=C3N=C2OCC)C=4C=CC=CC4C5=NN=N[N-]5
database_cross_reference: PMID:18674515
has exact synonym: 2-ethoxy-1-{[2'-(tetrazol-1-id-5-yl)[biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carboxylate
has OBO namespace: chebi_ontology
has related synonym: candesartan
id: CHEBI:149509
in subset: 3 STAR

Axiom
annotated source: candesartan(2-)
annotated property: database_cross_reference
annotated target: PMID:18674515
source: SUBMITTER

Axiom
annotated source: candesartan(2-)
annotated property: has exact synonym
annotated target: 2-ethoxy-1-{[2'-(tetrazol-1-id-5-yl)[biphenyl]-4-yl]methyl}-1H-benzimidazole-7-carboxylate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: candesartan(2-)
annotated property: hasRelatedSynonym
annotated target: candesartan
database_cross_reference: UniProt

emetic
type: Class
subclass of: CHEBI_23888
definition: Any agent that induces nausea and vomiting.
has OBO namespace: chebi_ontology
has related synonym: emetics
id: CHEBI:149552
in subset: 3 STAR

Axiom
annotated source: emetic
annotated property: hasRelatedSynonym
annotated target: emetics
database_cross_reference: ChEBI

anticoronaviral agent
type: Class
subclass of: CHEBI_22587
definition: Any antiviral agent which inhibits the activity of coronaviruses.
database_cross_reference: Wikipedia:Coronavirus
has exact synonym: anticoronaviral agent
has OBO namespace: chebi_ontology
has related synonym: anti-coronaviral agent
has related synonym: anti-coronaviral agents
has related synonym: anti-coronavirus agent
has related synonym: anti-coronavirus agents
has related synonym: anticoronaviral agents
has related synonym: anticoronaviral drug
has related synonym: anticoronaviral drugs
has related synonym: anticoronavirus agent
has related synonym: anticoronavirus agents
has related synonym: anticoronviral agent
has related synonym: anticoronviral agents
id: CHEBI:149553
in subset: 3 STAR

Axiom
annotated source: anticoronaviral agent
annotated property: has exact synonym
annotated target: anticoronaviral agent
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anti-coronaviral agent
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anti-coronaviral agents
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anti-coronavirus agent
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anti-coronavirus agents
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronaviral agents
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronaviral drug
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronaviral drugs
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronavirus agent
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronavirus agents
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronviral agent
database_cross_reference: ChEBI

Axiom
annotated source: anticoronaviral agent
annotated property: hasRelatedSynonym
annotated target: anticoronviral agents
database_cross_reference: ChEBI

(1S,2R)-ephedrine(1+)
type: Class
subclass of: CHEBI_35274
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_57295
definition: An organic cation obtained by protonation of the secondary amino function of (1S,2R)-ephedrine; major species at pH 7.3.
charge: +1
formula: C10H16NO
inchi: InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/p+1/t8-,10-/m1/s1
inchikey: KWGRBVOPPLSCSI-PSASIEDQSA-O
mass: 166.243
monoisotopicmass: 166.12264
smiles: [C@H]([C@@H](C)[NH2+]C)(O)C1=CC=CC=C1
database_cross_reference: MetaCyc:CPD-22730
has exact synonym: (1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium
has OBO namespace: chebi_ontology
has related synonym: (+)-ephedrinium
has related synonym: (1S,2R)-ephedrine
has related synonym: (1S,2R)-ephedrinium
id: CHEBI:149673
in subset: 2 STAR

Axiom
annotated source: (1S,2R)-ephedrine(1+)
annotated property: database_cross_reference
annotated target: MetaCyc:CPD-22730
source: SUBMITTER

Axiom
annotated source: (1S,2R)-ephedrine(1+)
annotated property: has exact synonym
annotated target: (1S,2R)-1-hydroxy-N-methyl-1-phenylpropan-2-aminium
database_cross_reference: SUBMITTER
has synonym type: IUPAC NAME

Axiom
annotated source: (1S,2R)-ephedrine(1+)
annotated property: hasRelatedSynonym
annotated target: (+)-ephedrinium
database_cross_reference: SUBMITTER

Axiom
annotated source: (1S,2R)-ephedrine(1+)
annotated property: hasRelatedSynonym
annotated target: (1S,2R)-ephedrine
database_cross_reference: UniProt

Axiom
annotated source: (1S,2R)-ephedrine(1+)
annotated property: hasRelatedSynonym
annotated target: (1S,2R)-ephedrinium
database_cross_reference: SUBMITTER

D-dopa zwitterion
type: Class
subclass of: CHEBI_35238
subclass of: Restriction
  on property: is enantiomer of
  some values from: CHEBI_57504
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_49169
definition: An amino acid zwitterion obtained from the transfer of a proton from the carboxy group to the amino group of D-dopa. Major microspecies at pH 7.3.
charge: 0
formula: C9H11NO4
inchi: InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m1/s1
inchikey: WTDRDQBEARUVNC-ZCFIWIBFSA-N
mass: 197.190
monoisotopicmass: 197.06881
smiles: C1=C(O)C(=CC(C[C@H](C(=O)[O-])[NH3+])=C1)O
database_cross_reference: PMID:17303072
has exact synonym: (2R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)propanoate
has OBO namespace: chebi_ontology
has related synonym: (2R)-2-ammonio-3-(3,4-dihydroxyphenyl)propanoate
has related synonym: D-dopa
id: CHEBI:149689
in subset: 3 STAR

Axiom
annotated source: D-dopa zwitterion
annotated property: database_cross_reference
annotated target: PMID:17303072
source: SUBMITTER

Axiom
annotated source: D-dopa zwitterion
annotated property: has exact synonym
annotated target: (2R)-2-azaniumyl-3-(3,4-dihydroxyphenyl)propanoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: D-dopa zwitterion
annotated property: hasRelatedSynonym
annotated target: (2R)-2-ammonio-3-(3,4-dihydroxyphenyl)propanoate
database_cross_reference: SUBMITTER

Axiom
annotated source: D-dopa zwitterion
annotated property: hasRelatedSynonym
annotated target: D-dopa
database_cross_reference: UniProt

pyrazole
type: Class
subclass of: CHEBI_26410
subclass of: CHEBI_35555
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_38596
definition: A monocyclic heteroarene that is a five-membered organic heterocycle containing two nitrogen atoms at positions 1 and 2.
charge: 0
formula: C3H4N2
mass: 68.077
monoisotopicmass: 68.03745
database_cross_reference: PMID:24816008
database_cross_reference: Wikipedia:Pyrazole
has exact synonym: pyrazole
has OBO namespace: chebi_ontology
has related synonym: Pyrazol
id: CHEBI:14973
in subset: 3 STAR

Axiom
annotated source: pyrazole
annotated property: database_cross_reference
annotated target: PMID:24816008
source: Europe PMC

Axiom
annotated source: pyrazole
annotated property: has exact synonym
annotated target: pyrazole
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: pyrazole
annotated property: hasRelatedSynonym
annotated target: Pyrazol
database_cross_reference: ChEBI

electron donor
type: Class
subclass of: CHEBI_17891
definition: A molecular entity that can transfer an electron to another molecular entity.
has exact synonym: electron donor
has OBO namespace: chebi_ontology
has related synonym: Elektronendonator
has related synonym: donneur d'electron
id: CHEBI:15022
in subset: 3 STAR

Axiom
annotated source: electron donor
annotated property: has exact synonym
annotated target: electron donor
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: electron donor
annotated property: hasRelatedSynonym
annotated target: Elektronendonator
database_cross_reference: ChEBI

Axiom
annotated source: electron donor
annotated property: hasRelatedSynonym
annotated target: donneur d'electron
database_cross_reference: IUPAC

retinal
type: Class
subclass of: CHEBI_26534
subclass of: CHEBI_51688
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
definition: An enal that consists of 3,7-dimethyl-9-nona-2,4,6,8-tetraenal (double bond geometry unspecified) carrying a 2,6,6-trimethylcyclohex-1-en-1-yl group at the 9-position.
charge: 0
formula: C20H28O
inchi: InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3
inchikey: NCYCYZXNIZJOKI-UHFFFAOYSA-N
mass: 284.43572
monoisotopicmass: 284.21402
database_cross_reference: MetaCyc:Retinals
database_cross_reference: Reaxys:2055098
has exact synonym: 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal
has exact synonym: retinal
has OBO namespace: chebi_ontology
id: CHEBI:15035
in subset: 3 STAR

Axiom
annotated source: retinal
annotated property: database_cross_reference
annotated target: Reaxys:2055098
source: Reaxys

Axiom
annotated source: retinal
annotated property: has exact synonym
annotated target: 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenal
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: retinal
annotated property: has exact synonym
annotated target: retinal
database_cross_reference: UniProt

retinoate
type: Class
subclass of: retinoid anion
subclass of: CHEBI_35757
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_26536
charge: -1
formula: C20H27O2
inchi: InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/p-1
inchikey: SHGAZHPCJJPHSC-UHFFFAOYSA-M
mass: 299.42718
monoisotopicmass: 299.20165
smiles: CC(C=CC1=C(C)CCCC1(C)C)=CC=CC(C)=CC([O-])=O
has exact synonym: 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
has exact synonym: retinoate
has OBO namespace: chebi_ontology
id: CHEBI:15036
in subset: 3 STAR

Axiom
annotated source: retinoate
annotated property: has exact synonym
annotated target: 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoate
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: retinoate
annotated property: has exact synonym
annotated target: retinoate
database_cross_reference: UniProt

retinyl palmitate
type: Class
subclass of: vitamin A
subclass of: CHEBI_25835
definition: A palmitate ester of retinol with undefined geometry about the C=C bonds.
IAO_0000118: retinyl palmitate
IAO_0000412: chebi.owl
IAO_0000412: http://langual.org
database_cross_reference: http://www.langual.org/langual_thesaurus.asp

sulfide(2-)
type: Class
subclass of: CHEBI_79388
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_29919
definition: A divalent inorganic anion obtained by removal of both protons from hydrogen sulfide.
charge: -2
formula: S
inchi: InChI=1S/S/q-2
inchikey: UCKMPCXJQFINFW-UHFFFAOYSA-N
mass: 32.06600
monoisotopicmass: 31.97317
smiles: [S--]
database_cross_reference: CAS:18496-25-8
database_cross_reference: UM-BBD_compID:c0569
has exact synonym: sulfanediide
has exact synonym: sulfide(2-)
has OBO namespace: chebi_ontology
has related synonym: S(2-)
has related synonym: Sulfide
has related synonym: sulphide
id: CHEBI:15138
in subset: 3 STAR

Axiom
annotated source: sulfide(2-)
annotated property: database_cross_reference
annotated target: CAS:18496-25-8
source: ChemIDplus

Axiom
annotated source: sulfide(2-)
annotated property: database_cross_reference
annotated target: UM-BBD_compID:c0569
source: UM-BBD

Axiom
annotated source: sulfide(2-)
annotated property: has exact synonym
annotated target: sulfanediide
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: sulfide(2-)
annotated property: has exact synonym
annotated target: sulfide(2-)
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: sulfide(2-)
annotated property: hasRelatedSynonym
annotated target: S(2-)
database_cross_reference: IUPAC

Axiom
annotated source: sulfide(2-)
annotated property: hasRelatedSynonym
annotated target: Sulfide
database_cross_reference: ChemIDplus

Axiom
annotated source: sulfide(2-)
annotated property: hasRelatedSynonym
annotated target: sulphide
database_cross_reference: ChEBI

trichlorophenols
type: Class
subclass of: CHEBI_23150
subclass of: CHEBI_27096
definition: Any chlorophenol derivative that contains three covalently bonded chlorine atoms.
has OBO namespace: chebi_ontology
id: CHEBI:15258
in subset: 3 STAR

xanthine
type: Class
subclass of: CHEBI_25810
subclass of: CHEBI_26386
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78675
subclass of: Restriction
  on property: has functional parent
  some values from: CHEBI_16235
definition: A purine nucleobase found in humans and other organisms.
charge: 0
formula: C5H4N4O2
mass: 152.111
monoisotopicmass: 152.03343
database_cross_reference: ECMDB:ECMDB00292
database_cross_reference: KNApSAcK:C00019660
database_cross_reference: PMID:1557408
database_cross_reference: PMID:24629268
database_cross_reference: PMID:9007687
database_cross_reference: YMDB:YMDB00263
has exact synonym: xanthine
has OBO namespace: chebi_ontology
has related synonym: 2,6-dioxopurine
has related synonym: 2,6-dioxopurines
has related synonym: xanthines
id: CHEBI:15318
in subset: 3 STAR

Axiom
annotated source: xanthine
annotated property: database_cross_reference
annotated target: PMID:1557408
source: Europe PMC

Axiom
annotated source: xanthine
annotated property: database_cross_reference
annotated target: PMID:24629268
source: Europe PMC

Axiom
annotated source: xanthine
annotated property: database_cross_reference
annotated target: PMID:9007687
source: Europe PMC

Axiom
annotated source: xanthine
annotated property: has exact synonym
annotated target: xanthine
database_cross_reference: ChEBI

Axiom
annotated source: xanthine
annotated property: hasRelatedSynonym
annotated target: 2,6-dioxopurine
database_cross_reference: ChEBI

Axiom
annotated source: xanthine
annotated property: hasRelatedSynonym
annotated target: 2,6-dioxopurines
database_cross_reference: ChEBI

Axiom
annotated source: xanthine
annotated property: hasRelatedSynonym
annotated target: xanthines
database_cross_reference: ChEBI

acceptor
type: Class
subclass of: CHEBI_51086
definition: A molecular entity that can accept an electron, a pair of electrons, an atom or a group from another molecular entity.
has alternative id: CHEBI:13699
has alternative id: CHEBI:2377
database_cross_reference: KEGG:C00028
database_cross_reference: KEGG:C16722
has exact synonym: Acceptor
has OBO namespace: chebi_ontology
has related synonym: A
has related synonym: Akzeptor
has related synonym: Hydrogen-acceptor
has related synonym: Oxidized donor
has related synonym: accepteur
id: CHEBI:15339
in subset: 3 STAR

Axiom
annotated source: acceptor
annotated property: has exact synonym
annotated target: Acceptor
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acceptor
annotated property: hasRelatedSynonym
annotated target: A
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acceptor
annotated property: hasRelatedSynonym
annotated target: Akzeptor
database_cross_reference: ChEBI

Axiom
annotated source: acceptor
annotated property: hasRelatedSynonym
annotated target: Hydrogen-acceptor
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acceptor
annotated property: hasRelatedSynonym
annotated target: Oxidized donor
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acceptor
annotated property: hasRelatedSynonym
annotated target: accepteur
database_cross_reference: ChEBI

acetaldehyde
type: Class
subclass of: CHEBI_17478
subclass of: Restriction
  on property: has role
  some values from: CHEBI_17654
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25435
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50903
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50905
subclass of: Restriction
  on property: has role
  some values from: CHEBI_63248
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75772
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76971
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77941
definition: The aldehyde formed from acetic acid by reduction of the carboxy group. It is the most abundant carcinogen in tobacco smoke.
charge: 0
formula: C2H4O
inchi: InChI=1S/C2H4O/c1-2-3/h2H,1H3
inchikey: IKHGUXGNUITLKF-UHFFFAOYSA-N
mass: 44.05256
monoisotopicmass: 44.02621
smiles: [H]C(C)=O
has alternative id: CHEBI:13703
has alternative id: CHEBI:22158
has alternative id: CHEBI:2383
has alternative id: CHEBI:40533
database_cross_reference: Beilstein:505984
database_cross_reference: CAS:75-07-0
database_cross_reference: Gmelin:779
database_cross_reference: HMDB:HMDB0000990
database_cross_reference: KEGG:C00084
database_cross_reference: KNApSAcK:C00007392
database_cross_reference: LINCS:LSM-37193
database_cross_reference: PDBeChem:ACE
database_cross_reference: PMID:11058591
database_cross_reference: PMID:110589
database_cross_reference: PMID:11087437
database_cross_reference: PMID:11290854
database_cross_reference: PMID:15239123
database_cross_reference: PMID:15833031
database_cross_reference: PMID:16404561
database_cross_reference: PMID:16485909
database_cross_reference: PMID:18001279
database_cross_reference: PMID:19396661
database_cross_reference: PMID:2233695
database_cross_reference: PMID:24282063
database_cross_reference: PMID:24326678
database_cross_reference: PMID:24503565
database_cross_reference: PMID:4239189
database_cross_reference: PMID:5526694
database_cross_reference: PMID:6036728
database_cross_reference: PMID:7163973
database_cross_reference: PMID:9171333
database_cross_reference: Reaxys:505984
database_cross_reference: UM-BBD_compID:c0160
database_cross_reference: Wikipedia:Acetaldehyde
has exact synonym: ACETALDEHYDE
has exact synonym: Acetaldehyde
has exact synonym: acetaldehyde
has OBO namespace: chebi_ontology
has related synonym: Acetaldehyd
has related synonym: Azetaldehyd
has related synonym: Ethanal
has related synonym: acetaldehydes
has related synonym: acetic aldehyde
has related synonym: ethyl aldehyde
id: CHEBI:15343
in subset: 3 STAR

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: Beilstein:505984
source: Beilstein

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: CAS:75-07-0
source: ChemIDplus

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: CAS:75-07-0
source: KEGG COMPOUND

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: CAS:75-07-0
source: NIST Chemistry WebBook

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: Gmelin:779
source: Gmelin

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:11058591
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:110589
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:11087437
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:11290854
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:15239123
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:15833031
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:16404561
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:16485909
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:18001279
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:19396661
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:2233695
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:24282063
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:24326678
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:24503565
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:4239189
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:5526694
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:6036728
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:7163973
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: PMID:9171333
source: Europe PMC

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: Reaxys:505984
source: Reaxys

Axiom
annotated source: acetaldehyde
annotated property: database_cross_reference
annotated target: UM-BBD_compID:c0160
source: UM-BBD

Axiom
annotated source: acetaldehyde
annotated property: has exact synonym
annotated target: ACETALDEHYDE
database_cross_reference: PDBeChem

Axiom
annotated source: acetaldehyde
annotated property: has exact synonym
annotated target: Acetaldehyde
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetaldehyde
annotated property: has exact synonym
annotated target: acetaldehyde
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetaldehyde
annotated property: has exact synonym
annotated target: acetaldehyde
database_cross_reference: UniProt

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: Acetaldehyd
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: Azetaldehyd
database_cross_reference: ChEBI

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: Ethanal
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: acetaldehydes
database_cross_reference: ChEBI

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: acetic aldehyde
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: acetaldehyde
annotated property: hasRelatedSynonym
annotated target: ethyl aldehyde
database_cross_reference: NIST_Chemistry_WebBook

acetone
type: Class
subclass of: volatile organic compound
subclass of: CHEBI_26292
subclass of: CHEBI_51867
subclass of: CHEBI_73693
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48358
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77941
definition: A methyl ketone that consists of propane bearing an oxo group at C2.
charge: 0
formula: C3H6O
inchi: InChI=1S/C3H6O/c1-3(2)4/h1-2H3
inchikey: CSCPPACGZOOCGX-UHFFFAOYSA-N
mass: 58.07914
monoisotopicmass: 58.04186
smiles: CC(C)=O
has alternative id: CHEBI:13708
has alternative id: CHEBI:22182
has alternative id: CHEBI:2398
has alternative id: CHEBI:40571
database_cross_reference: Beilstein:635680
database_cross_reference: CAS:67-64-1
database_cross_reference: Gmelin:1466
database_cross_reference: HMDB:HMDB0001659
database_cross_reference: KEGG:C00207
database_cross_reference: KEGG:D02311
database_cross_reference: LIPID_MAPS_instance:LMFA12000057
database_cross_reference: MetaCyc:ACETONE
database_cross_reference: PDBeChem:ACN
database_cross_reference: PMID:17190852
database_cross_reference: PMID:17347819
database_cross_reference: Reaxys:635680
database_cross_reference: UM-BBD_compID:c0556
database_cross_reference: Wikipedia:Acetone
has exact synonym: ACETONE
has exact synonym: Acetone
has exact synonym: acetone
has exact synonym: propan-2-one
has OBO namespace: chebi_ontology
has related synonym: 2-Propanone
has related synonym: Aceton
has related synonym: Azeton
has related synonym: Dimethyl ketone
has related synonym: Dimethylketon
has related synonym: Propanon
has related synonym: Pyroacetic ether
has related synonym: beta-Ketopropane
has related synonym: dimethylcetone
has related synonym: dimethylketone
has related synonym: methyl ketone
has related synonym: propanone
id: CHEBI:15347
in subset: 3 STAR

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: Beilstein:635680
source: Beilstein

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: CAS:67-64-1
source: ChemIDplus

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: CAS:67-64-1
source: KEGG COMPOUND

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: CAS:67-64-1
source: NIST Chemistry WebBook

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: Gmelin:1466
source: Gmelin

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: LIPID_MAPS_instance:LMFA12000057
source: LIPID MAPS

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: PMID:17190852
source: Europe PMC

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: PMID:17347819
source: Europe PMC

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: Reaxys:635680
source: Reaxys

Axiom
annotated source: acetone
annotated property: database_cross_reference
annotated target: UM-BBD_compID:c0556
source: UM-BBD

Axiom
annotated source: acetone
annotated property: has exact synonym
annotated target: ACETONE
database_cross_reference: PDBeChem

Axiom
annotated source: acetone
annotated property: has exact synonym
annotated target: Acetone
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetone
annotated property: has exact synonym
annotated target: acetone
database_cross_reference: ChEBI

Axiom
annotated source: acetone
annotated property: has exact synonym
annotated target: acetone
database_cross_reference: UniProt

Axiom
annotated source: acetone
annotated property: has exact synonym
annotated target: propan-2-one
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: 2-Propanone
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Aceton
database_cross_reference: ChemIDplus

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Azeton
database_cross_reference: ChEBI

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Dimethyl ketone
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Dimethylketon
database_cross_reference: ChEBI

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Propanon
database_cross_reference: ChEBI

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: Pyroacetic ether
database_cross_reference: HMDB

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: beta-Ketopropane
database_cross_reference: HMDB

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: dimethylcetone
database_cross_reference: ChEBI

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: dimethylketone
database_cross_reference: MetaCyc

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: methyl ketone
database_cross_reference: ChemIDplus

Axiom
annotated source: acetone
annotated property: hasRelatedSynonym
annotated target: propanone
database_cross_reference: ChemIDplus

2-hydroxy-2-methylpropanenitrile
type: Class
subclass of: CHEBI_23437
charge: 0
formula: C4H7NO
inchi: InChI=1S/C4H7NO/c1-4(2,6)3-5/h6H,1-2H3
inchikey: MWFMGBPGAXYFAR-UHFFFAOYSA-N
mass: 85.10452
monoisotopicmass: 85.05276
smiles: CC(C)(O)C#N
has alternative id: CHEBI:11581
has alternative id: CHEBI:11597
has alternative id: CHEBI:13709
has alternative id: CHEBI:22184
has alternative id: CHEBI:2399
has alternative id: CHEBI:41622
database_cross_reference: CAS:75-86-5
database_cross_reference: DrugBank:DB02203
database_cross_reference: KEGG:C02659
has exact synonym: 2-Hydroxy-2-methylpropanenitrile
has exact synonym: 2-hydroxy-2-methylpropanenitrile
has OBO namespace: chebi_ontology
has related synonym: 2-Hydroxyisobutyronitrile
has related synonym: 2-Methyllactonitrile
has related synonym: Acetone cyanhydrin
has related synonym: Acetone cyanohydrin
has related synonym: acetone-cyanohydrin
has related synonym: alpha-Hydroxyisobutyronitrile
id: CHEBI:15348
in subset: 3 STAR

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: database_cross_reference
annotated target: CAS:75-86-5
source: KEGG COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: has exact synonym
annotated target: 2-Hydroxy-2-methylpropanenitrile
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: has exact synonym
annotated target: 2-hydroxy-2-methylpropanenitrile
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: has exact synonym
annotated target: 2-hydroxy-2-methylpropanenitrile
database_cross_reference: UniProt

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: 2-Hydroxyisobutyronitrile
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: 2-Methyllactonitrile
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: Acetone cyanhydrin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: Acetone cyanohydrin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: acetone-cyanohydrin
database_cross_reference: ChEBI

Axiom
annotated source: 2-hydroxy-2-methylpropanenitrile
annotated property: hasRelatedSynonym
annotated target: alpha-Hydroxyisobutyronitrile
database_cross_reference: KEGG_COMPOUND

choline
type: Class
subclass of: CHEBI_23217
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25512
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33284
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50904
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75772
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76924
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76971
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: has role
  some values from: CHEBI_83056
definition: A choline that is the parent compound of the cholines class, consisting of ethanolamine having three methyl substituents attached to the amino function.
charge: +1
formula: C5H14NO
inchi: InChI=1S/C5H14NO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
inchikey: OEYIOHPDSNJKLS-UHFFFAOYSA-N
mass: 104.17080
monoisotopicmass: 104.10699
smiles: C[N+](C)(C)CCO
has alternative id: CHEBI:13985
has alternative id: CHEBI:23212
has alternative id: CHEBI:3665
has alternative id: CHEBI:41524
database_cross_reference: Beilstein:1736748
database_cross_reference: CAS:62-49-7
database_cross_reference: DrugBank:DB00122
database_cross_reference: Drug_Central:3097
database_cross_reference: ECMDB:ECMDB00097
database_cross_reference: Gmelin:324597
database_cross_reference: HMDB:HMDB0000097
database_cross_reference: KEGG:C00114
database_cross_reference: KEGG:D07690
database_cross_reference: KNApSAcK:C00007298
database_cross_reference: MetaCyc:CHOLINE
database_cross_reference: PDBeChem:CHT
database_cross_reference: PMID:10930630
database_cross_reference: PMID:12826235
database_cross_reference: PMID:12946691
database_cross_reference: PMID:14972364
database_cross_reference: PMID:16210714
database_cross_reference: PMID:17087106
database_cross_reference: PMID:17283071
database_cross_reference: PMID:17344490
database_cross_reference: PMID:18204095
database_cross_reference: PMID:18230680
database_cross_reference: PMID:18786517
database_cross_reference: PMID:18786520
database_cross_reference: PMID:19246089
database_cross_reference: PMID:20038853
database_cross_reference: PMID:20446114
database_cross_reference: PMID:22770225
database_cross_reference: PMID:22961562
database_cross_reference: PMID:23095202
database_cross_reference: PMID:23616508
database_cross_reference: PMID:23637565
database_cross_reference: PMID:23733158
database_cross_reference: PMID:6420466
database_cross_reference: PMID:7590654
database_cross_reference: PMID:9517478
database_cross_reference: Reaxys:1736748
database_cross_reference: Wikipedia:Choline
database_cross_reference: YMDB:YMDB00227
has exact synonym: 2-hydroxy-N,N,N-trimethylethanaminium
has exact synonym: Choline
has exact synonym: choline
has OBO namespace: chebi_ontology
has related synonym: Bilineurine
has related synonym: CHOLINE ION
has related synonym: N,N,N-trimethylethanol-ammonium
has related synonym: N-trimethylethanolamine
has related synonym: trimethylethanolamine
id: CHEBI:15354
in subset: 3 STAR

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: Beilstein:1736748
source: Beilstein

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: CAS:62-49-7
source: ChemIDplus

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: CAS:62-49-7
source: KEGG COMPOUND

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: Drug_Central:3097
source: DrugCentral

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: Gmelin:324597
source: Gmelin

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:10930630
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:12826235
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:12946691
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:14972364
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:16210714
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:17087106
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:17283071
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:17344490
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:18204095
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:18230680
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:18786517
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:18786520
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:19246089
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:20038853
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:20446114
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:22770225
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:22961562
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:23095202
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:23616508
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:23637565
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:23733158
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:6420466
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:7590654
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: PMID:9517478
source: Europe PMC

Axiom
annotated source: choline
annotated property: database_cross_reference
annotated target: Reaxys:1736748
source: Reaxys

Axiom
annotated source: choline
annotated property: has exact synonym
annotated target: 2-hydroxy-N,N,N-trimethylethanaminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: choline
annotated property: has exact synonym
annotated target: Choline
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: choline
annotated property: has exact synonym
annotated target: choline
database_cross_reference: UniProt

Axiom
annotated source: choline
annotated property: hasRelatedSynonym
annotated target: Bilineurine
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: choline
annotated property: hasRelatedSynonym
annotated target: CHOLINE ION
database_cross_reference: PDBeChem

Axiom
annotated source: choline
annotated property: hasRelatedSynonym
annotated target: N,N,N-trimethylethanol-ammonium
database_cross_reference: ChEBI

Axiom
annotated source: choline
annotated property: hasRelatedSynonym
annotated target: N-trimethylethanolamine
database_cross_reference: ChEBI

Axiom
annotated source: choline
annotated property: hasRelatedSynonym
annotated target: trimethylethanolamine
database_cross_reference: ChEBI

acetylcholine
type: Class
subclass of: CHEBI_35287
subclass of: CHEBI_47622
subclass of: Restriction
  on property: has role
  some values from: CHEBI_24621
subclass of: Restriction
  on property: has role
  some values from: CHEBI_25512
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35620
subclass of: Restriction
  on property: has role
  some values from: CHEBI_38325
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
definition: Actylcholine is an ester of acetic acid and choline, which acts as a neurotransmitter.
charge: +1
formula: C7H16NO2
inchi: InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1
inchikey: OIPILFWXSMYKGL-UHFFFAOYSA-N
mass: 146.20748
monoisotopicmass: 146.11756
smiles: CC(=O)OCC[N+](C)(C)C
has alternative id: CHEBI:12686
has alternative id: CHEBI:13715
has alternative id: CHEBI:22197
has alternative id: CHEBI:2416
has alternative id: CHEBI:40559
database_cross_reference: Beilstein:1764436
database_cross_reference: CAS:51-84-3
database_cross_reference: DrugBank:DB03128
database_cross_reference: Drug_Central:65
database_cross_reference: Gmelin:326108
database_cross_reference: KEGG:C01996
database_cross_reference: LINCS:LSM-5888
database_cross_reference: PDBeChem:ACH
database_cross_reference: PMID:14764638
database_cross_reference: PMID:15014918
database_cross_reference: PMID:15231705
database_cross_reference: PMID:15361288
database_cross_reference: PMID:18050502
database_cross_reference: PMID:18407448
database_cross_reference: PMID:19255787
database_cross_reference: PMID:20963497
database_cross_reference: PMID:21130809
database_cross_reference: PMID:21246223
database_cross_reference: PMID:21545631
database_cross_reference: PMID:21601579
database_cross_reference: Wikipedia:Acetylcholine
has exact synonym: 2-acetyloxy-N,N,N-trimethylethanaminium
has exact synonym: ACETYLCHOLINE
has exact synonym: Acetylcholine
has exact synonym: acetylcholine
has OBO namespace: chebi_ontology
has related synonym: ACh
has related synonym: Azetylcholin
has related synonym: O-Acetylcholine
has related synonym: choline acetate
id: CHEBI:15355
in subset: 3 STAR

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: Beilstein:1764436
source: ChemIDplus

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: CAS:51-84-3
source: ChemIDplus

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: CAS:51-84-3
source: KEGG COMPOUND

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: Drug_Central:65
source: DrugCentral

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: Gmelin:326108
source: Gmelin

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:14764638
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:15014918
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:15231705
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:15361288
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:18050502
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:18407448
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:19255787
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:20963497
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:21130809
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:21246223
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:21545631
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: database_cross_reference
annotated target: PMID:21601579
source: Europe PMC

Axiom
annotated source: acetylcholine
annotated property: has exact synonym
annotated target: 2-acetyloxy-N,N,N-trimethylethanaminium
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetylcholine
annotated property: has exact synonym
annotated target: ACETYLCHOLINE
database_cross_reference: PDBeChem

Axiom
annotated source: acetylcholine
annotated property: has exact synonym
annotated target: Acetylcholine
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylcholine
annotated property: has exact synonym
annotated target: acetylcholine
database_cross_reference: UniProt

Axiom
annotated source: acetylcholine
annotated property: hasRelatedSynonym
annotated target: ACh
database_cross_reference: ChemIDplus

Axiom
annotated source: acetylcholine
annotated property: hasRelatedSynonym
annotated target: Azetylcholin
database_cross_reference: ChEBI

Axiom
annotated source: acetylcholine
annotated property: hasRelatedSynonym
annotated target: O-Acetylcholine
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylcholine
annotated property: hasRelatedSynonym
annotated target: choline acetate
database_cross_reference: ChemIDplus

cysteine
type: Class
subclass of: CHEBI_26167
subclass of: CHEBI_26834
subclass of: CHEBI_33704
subclass of: Restriction
  on property: has part
  some values from: CHEBI_50326
subclass of: Restriction
  on property: has role
  some values from: CHEBI_78675
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_32456
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_32458
subclass of: Restriction
  on property: is tautomer of
  some values from: CHEBI_35237
definition: A sulfur-containing amino acid that is propanoic acid with an amino group at position 2 and a sulfanyl group at position 3.
IAO_0000412: cdno.owl
IAO_0000412: chebi.owl
charge: 0
formula: C3H7NO2S
inchi: InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)
inchikey: XUJNEKJLAYXESH-UHFFFAOYSA-N
mass: 121.15922
monoisotopicmass: 121.01975
smiles: NC(CS)C(O)=O
has alternative id: CHEBI:14061
has alternative id: CHEBI:23508
has alternative id: CHEBI:4050
database_cross_reference: Beilstein:1721406
database_cross_reference: CAS:3374-22-9
database_cross_reference: Gmelin:2933
database_cross_reference: KEGG:C00736
database_cross_reference: KNApSAcK:C00001351
database_cross_reference: KNApSAcK:C00007323
database_cross_reference: PMID:17439666
database_cross_reference: PMID:25181601
database_cross_reference: Reaxys:1721406
database_cross_reference: Wikipedia:Cysteine
has exact synonym: Cysteine
has exact synonym: cysteine
has OBO namespace: chebi_ontology
has related synonym: 2-Amino-3-mercaptopropionic acid
has related synonym: 2-amino-3-mercaptopropanoic acid
has related synonym: 2-amino-3-sulfanylpropanoic acid
has related synonym: C
has related synonym: Cys
has related synonym: Cystein
has related synonym: Hcys
has related synonym: Zystein
has related synonym: cisteina
id: CHEBI:15356
in subset: 3 STAR

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: Beilstein:1721406
source: Beilstein

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: CAS:3374-22-9
source: ChemIDplus

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: CAS:3374-22-9
source: KEGG COMPOUND

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: CAS:3374-22-9
source: NIST Chemistry WebBook

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: Gmelin:2933
source: Gmelin

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: PMID:17439666
source: Europe PMC

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: PMID:25181601
source: Europe PMC

Axiom
annotated source: cysteine
annotated property: database_cross_reference
annotated target: Reaxys:1721406
source: Reaxys

Axiom
annotated source: cysteine
annotated property: has exact synonym
annotated target: Cysteine
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: cysteine
annotated property: has exact synonym
annotated target: cysteine
database_cross_reference: ChEBI

Axiom
annotated source: cysteine
annotated property: has exact synonym
annotated target: cysteine
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: 2-Amino-3-mercaptopropionic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: 2-amino-3-mercaptopropanoic acid
database_cross_reference: JCBN

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: 2-amino-3-sulfanylpropanoic acid
database_cross_reference: IUPAC

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: C
database_cross_reference: ChEBI

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: Cys
database_cross_reference: ChEBI

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: Cystein
database_cross_reference: ChEBI

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: Hcys
database_cross_reference: IUPAC

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: Zystein
database_cross_reference: ChEBI

Axiom
annotated source: cysteine
annotated property: hasRelatedSynonym
annotated target: cisteina
database_cross_reference: ChEBI

acetylsalicylic acid
type: Class
subclass of: phenyl acetates
subclass of: CHEBI_22723
subclass of: CHEBI_26596
subclass of: Restriction
  on property: has role
  some values from: CHEBI_176497
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35475
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35481
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35493
subclass of: Restriction
  on property: has role
  some values from: CHEBI_49023
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50249
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50427
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50629
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50630
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50905
definition: A member of the class of benzoic acids that is salicylic acid in which the hydrogen that is attached to the phenolic hydroxy group has been replaced by an acetoxy group. A non-steroidal anti-inflammatory drug with cyclooxygenase inhibitor activity.
charge: 0
formula: C9H8O4
inchi: InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)
inchikey: BSYNRYMUTXBXSQ-UHFFFAOYSA-N
mass: 180.15740
monoisotopicmass: 180.04226
smiles: CC(=O)Oc1ccccc1C(O)=O
has alternative id: CHEBI:22188
has alternative id: CHEBI:22203
has alternative id: CHEBI:2890
has alternative id: CHEBI:40705
has alternative id: CHEBI:71414
database_cross_reference: Beilstein:779271
database_cross_reference: CAS:50-78-2
database_cross_reference: DrugBank:DB00945
database_cross_reference: Drug_Central:74
database_cross_reference: Gmelin:218864
database_cross_reference: HMDB:HMDB0001879
database_cross_reference: KEGG:C01405
database_cross_reference: KEGG:D00109
database_cross_reference: LINCS:LSM-5288
database_cross_reference: MetaCyc:CPD-524
database_cross_reference: PDBeChem:AIN
database_cross_reference: PMID:11203441
database_cross_reference: PMID:11402787
database_cross_reference: PMID:11597554
database_cross_reference: PMID:11733186
database_cross_reference: PMID:12852484
database_cross_reference: PMID:14753751
database_cross_reference: PMID:15542410
database_cross_reference: PMID:15590729
database_cross_reference: PMID:1650428
database_cross_reference: PMID:18226435
database_cross_reference: PMID:18335236
database_cross_reference: PMID:18631321
database_cross_reference: PMID:19010312
database_cross_reference: PMID:19386367
database_cross_reference: PMID:19706045
database_cross_reference: PMID:21699808
database_cross_reference: PMID:22866967
database_cross_reference: PMID:445303
database_cross_reference: Reaxys:779271
database_cross_reference: Wikipedia:Aspirin
has exact synonym: 2-(acetyloxy)benzoic acid
has exact synonym: Acetylsalicylic acid
has OBO namespace: chebi_ontology
has related synonym: 2-(ACETYLOXY)BENZOIC ACID
has related synonym: 2-Acetoxybenzenecarboxylic acid
has related synonym: 2-acetoxybenzoic acid
has related synonym: ASA
has related synonym: Acetylsalicylate
has related synonym: Acetylsalicylsaeure
has related synonym: Aspirin
has related synonym: Azetylsalizylsaeure
has related synonym: Easprin
has related synonym: O-acetylsalicylic acid
has related synonym: acide 2-(acetyloxy)benzoique
has related synonym: acide acetylsalicylique
has related synonym: acido acetilsalicilico
has related synonym: acidum acetylsalicylicum
has related synonym: o-acetoxybenzoic acid
has related synonym: o-carboxyphenyl acetate
has related synonym: salicylic acid acetate
id: CHEBI:15365
in subset: 3 STAR

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: Beilstein:779271
source: Beilstein

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: CAS:50-78-2
source: ChemIDplus

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: CAS:50-78-2
source: KEGG COMPOUND

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: CAS:50-78-2
source: NIST Chemistry WebBook

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: Drug_Central:74
source: DrugCentral

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: Gmelin:218864
source: Gmelin

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:11203441
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:11402787
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:11597554
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:11733186
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:12852484
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:14753751
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:15542410
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:15590729
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:1650428
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:18226435
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:18335236
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:18631321
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:19010312
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:19386367
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:19706045
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:21699808
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:22866967
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: PMID:445303
source: Europe PMC

Axiom
annotated source: acetylsalicylic acid
annotated property: database_cross_reference
annotated target: Reaxys:779271
source: Reaxys

Axiom
annotated source: acetylsalicylic acid
annotated property: has exact synonym
annotated target: 2-(acetyloxy)benzoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetylsalicylic acid
annotated property: has exact synonym
annotated target: Acetylsalicylic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: 2-(ACETYLOXY)BENZOIC ACID
database_cross_reference: PDBeChem

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: 2-Acetoxybenzenecarboxylic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: 2-acetoxybenzoic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: ASA
database_cross_reference: ChemIDplus

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: Acetylsalicylate
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: Acetylsalicylsaeure
database_cross_reference: ChemIDplus

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: Aspirin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: Azetylsalizylsaeure
database_cross_reference: ChEBI

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: Easprin
database_cross_reference: KEGG_DRUG
has synonym type: BRAND NAME

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: O-acetylsalicylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: acide 2-(acetyloxy)benzoique
database_cross_reference: IUPAC

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: acide acetylsalicylique
database_cross_reference: ChemIDplus
has synonym type: INN

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: acido acetilsalicilico
database_cross_reference: NIST_Chemistry_WebBook
has synonym type: INN

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: acidum acetylsalicylicum
database_cross_reference: NIST_Chemistry_WebBook
has synonym type: INN

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: o-acetoxybenzoic acid
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: o-carboxyphenyl acetate
database_cross_reference: NIST_Chemistry_WebBook

Axiom
annotated source: acetylsalicylic acid
annotated property: hasRelatedSynonym
annotated target: salicylic acid acetate
database_cross_reference: ChemIDplus

acetic acid
type: Class
subclass of: CHEBI_25384
subclass of: FOODON_03412972
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48356
subclass of: Restriction
  on property: has role
  some values from: CHEBI_64049
subclass of: Restriction
  on property: has role
  some values from: CHEBI_65256
subclass of: Restriction
  on property: has role
  some values from: CHEBI_83056
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_30089
definition: A simple monocarboxylic acid containing two carbons.
IAO_0000118: acetic acid
IAO_0000412: cdno.owl
IAO_0000412: chebi.owl
IAO_0000412: http://langual.org
charge: 0
formula: C2H4O2
inchi: InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)
inchikey: QTBSBXVTEAMEQO-UHFFFAOYSA-N
mass: 60.05200
monoisotopicmass: 60.02113
smiles: CC(O)=O
has alternative id: CHEBI:22169
has alternative id: CHEBI:2387
has alternative id: CHEBI:40486
database_cross_reference: Beilstein:506007
database_cross_reference: CAS:64-19-7
database_cross_reference: Codex::260
database_cross_reference: Drug_Central:4211
database_cross_reference: Europe::260
database_cross_reference: Gmelin:1380
database_cross_reference: HMDB:HMDB0000042
database_cross_reference: KEGG:C00033
database_cross_reference: KEGG:D00010
database_cross_reference: KNApSAcK:C00001176
database_cross_reference: LIPID_MAPS_instance:LMFA01010002
database_cross_reference: MetaCyc:ACET
database_cross_reference: PDBeChem:ACT
database_cross_reference: PDBeChem:ACY
database_cross_reference: PMID:12005138
database_cross_reference: PMID:15107950
database_cross_reference: PMID:16630552
database_cross_reference: PMID:16774200
database_cross_reference: PMID:17190852
database_cross_reference: PMID:19416101
database_cross_reference: PMID:19469536
database_cross_reference: PMID:22153255
database_cross_reference: PMID:22173419
database_cross_reference: PPDB:1333
database_cross_reference: Reaxys:506007
database_cross_reference: Wikipedia:Acetic_acid
database_cross_reference: http://www.langual.org/langual_thesaurus.asp
has exact synonym: ACETIC ACID
has exact synonym: Acetic acid
has exact synonym: acetic acid
has OBO namespace: chebi_ontology
has related synonym: AcOH
has related synonym: CH3-COOH
has related synonym: CH3CO2H
has related synonym: E 260
has related synonym: E-260
has related synonym: E260
has related synonym: Essigsaeure
has related synonym: Ethanoic acid
has related synonym: Ethylic acid
has related synonym: HOAc
has related synonym: INS No. 260
has related synonym: MeCO2H
has related synonym: MeCOOH
has related synonym: Methanecarboxylic acid
has related synonym: acide acetique
has related synonym: ethoic acid
has synonym: acetic acid, glacial
id: CHEBI:15366
in subset: 3 STAR
comment: LanguaL term definition: Food additive; technological purpose(s): acidity regulator, preservative.

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: Beilstein:506007
source: Beilstein

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: CAS:64-19-7
source: ChemIDplus

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: CAS:64-19-7
source: KEGG COMPOUND

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: CAS:64-19-7
source: NIST Chemistry WebBook

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: Drug_Central:4211
source: DrugCentral

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: Gmelin:1380
source: Gmelin

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: LIPID_MAPS_instance:LMFA01010002
source: LIPID MAPS

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:12005138
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:15107950
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:16630552
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:16774200
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:17190852
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:19416101
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:19469536
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:22153255
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: PMID:22173419
source: Europe PMC

Axiom
annotated source: acetic acid
annotated property: database_cross_reference
annotated target: Reaxys:506007
source: Reaxys

Axiom
annotated source: acetic acid
annotated property: has exact synonym
annotated target: ACETIC ACID
database_cross_reference: PDBeChem

Axiom
annotated source: acetic acid
annotated property: has exact synonym
annotated target: Acetic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetic acid
annotated property: has exact synonym
annotated target: acetic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: AcOH
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: CH3-COOH
database_cross_reference: IUPAC

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: CH3CO2H
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: E 260
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: E-260
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: E260
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: Essigsaeure
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: Ethanoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: Ethylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: HOAc
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: INS No. 260
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: MeCO2H
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: MeCOOH
database_cross_reference: ChEBI

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: Methanecarboxylic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: acide acetique
database_cross_reference: ChemIDplus

Axiom
annotated source: acetic acid
annotated property: hasRelatedSynonym
annotated target: ethoic acid
database_cross_reference: ChEBI

all-trans-retinoic acid
type: Class
subclass of: vitamin A
subclass of: CHEBI_26536
definition: A retinoic acid in which all four exocyclic double bonds have E- (trans-) geometry.
charge: 0
formula: C20H28O2
inchi: InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+
inchikey: SHGAZHPCJJPHSC-YCNIQYBTSA-N
mass: 300.43512
monoisotopicmass: 300.20893
smiles: CC(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(C)=C/C(O)=O
has alternative id: CHEBI:45376
has alternative id: CHEBI:8815
database_cross_reference: Beilstein:2057223
database_cross_reference: CAS:302-79-4
database_cross_reference: DrugBank:DB00755
database_cross_reference: Drug_Central:2722
database_cross_reference: FooDB:FDB022710
database_cross_reference: HMDB:HMDB0001852
database_cross_reference: KEGG:C00777
database_cross_reference: KEGG:D00094
database_cross_reference: LIPID_MAPS_instance:LMPR01090019
database_cross_reference: PDBeChem:REA
database_cross_reference: PMID:10022884
database_cross_reference: PMID:10970886
database_cross_reference: PMID:11073974
database_cross_reference: PMID:11214352
database_cross_reference: PMID:11332619
database_cross_reference: PMID:11343416
database_cross_reference: PMID:11437362
database_cross_reference: PMID:11556813
database_cross_reference: PMID:11722649
database_cross_reference: PMID:11896294
database_cross_reference: PMID:11904404
database_cross_reference: PMID:12958591
database_cross_reference: PMID:14581379
database_cross_reference: PMID:14605492
database_cross_reference: PMID:14627725
database_cross_reference: PMID:14704332
database_cross_reference: PMID:14705145
database_cross_reference: PMID:14978018
database_cross_reference: PMID:15194426
database_cross_reference: PMID:15318809
database_cross_reference: PMID:15327395
database_cross_reference: PMID:15359008
database_cross_reference: PMID:15376324
database_cross_reference: PMID:15476854
database_cross_reference: PMID:15537748
database_cross_reference: PMID:15539337
database_cross_reference: PMID:15675886
database_cross_reference: PMID:15839997
database_cross_reference: PMID:16569247
database_cross_reference: PMID:16685080
database_cross_reference: PMID:16688769
database_cross_reference: PMID:16720557
database_cross_reference: PMID:16819260
database_cross_reference: PMID:16847436
database_cross_reference: PMID:16920920
database_cross_reference: PMID:17073551
database_cross_reference: PMID:17166212
database_cross_reference: PMID:17204142
database_cross_reference: PMID:17447762
database_cross_reference: PMID:18052213
database_cross_reference: PMID:18085670
database_cross_reference: PMID:18162363
database_cross_reference: PMID:18183617
database_cross_reference: PMID:18318655
database_cross_reference: PMID:18322276
database_cross_reference: PMID:18400206
database_cross_reference: PMID:18404486
database_cross_reference: PMID:18440196
database_cross_reference: PMID:18678272
database_cross_reference: PMID:18800767
database_cross_reference: PMID:18819820
database_cross_reference: PMID:18977311
database_cross_reference: PMID:19018099
database_cross_reference: PMID:19112091
database_cross_reference: PMID:19144697
database_cross_reference: PMID:19427305
database_cross_reference: PMID:19587328

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: Beilstein:2057223
source: Beilstein

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: CAS:302-79-4
source: ChemIDplus

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: CAS:302-79-4
source: KEGG COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: Drug_Central:2722
source: DrugCentral

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: LIPID_MAPS_instance:LMPR01090019
source: LIPID MAPS

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:10022884
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:10970886
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11073974
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11214352
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11332619
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11343416
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11437362
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11556813
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11722649
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11896294
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:11904404
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:12958591
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14581379
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14605492
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14627725
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14704332
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14705145
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:14978018
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15194426
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15318809
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15327395
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15359008
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15376324
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15476854
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15537748
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15539337
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15675886
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:15839997
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16569247
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16685080
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16688769
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16720557
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16819260
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16847436
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:16920920
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:17073551
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:17166212
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:17204142
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:17447762
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18052213
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18085670
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18162363
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18183617
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18318655
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18322276
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18400206
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18404486
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18440196
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18678272
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18800767
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18819820
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:18977311
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19018099
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19112091
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19144697
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19427305
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19587328
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19597529
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19814868
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:19841174
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:21898109
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:21924320
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:21993673
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22134377
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22177959
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22180426
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22244299
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22261335
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22428994
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22514600
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22532966
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22534100
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22538278
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:22741806
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:27759097
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:29492455
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:33662750
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:33820492
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:34050114
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:34050360
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:34091189
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:7501014
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:7704533
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: PMID:7961949
source: Europe PMC

Axiom
annotated source: all-trans-retinoic acid
annotated property: database_cross_reference
annotated target: Reaxys:2057223
source: Reaxys

Axiom
annotated source: all-trans-retinoic acid
annotated property: has exact synonym
annotated target: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraenoic acid
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: has exact synonym
annotated target: all-trans-retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenoic acid
database_cross_reference: ChEBI

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: (all-E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraenoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: 3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,4,6,8-nonatetraenoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: 3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-enyl)nona-2,4,6,8-all-trans-tetraenoic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: 3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2E,4E,6E,8E-tetraenoic acid
database_cross_reference: LIPID_MAPS

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: AGN 100335
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Acide retinoique (French)
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Altreno
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Atralin
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Avita
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Betarretin
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Biacna
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Cordes vas
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Dermairol
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Refissa
database_cross_reference: ChemIDplus
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Renova
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Retin-A
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Retisol-A
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Ro 1-5488
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Stieva-A
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Tretin M
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Tri-luma
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Veltin
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: Vesanoid
database_cross_reference: DrugBank
has synonym type: BRAND NAME

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-(E)-retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-trans retinoic acid
database_cross_reference: ChemIDplus

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-trans-beta-Retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-trans-tretinoin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-trans-vitamin A acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: all-trans-vitamin A1 acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: beta-Retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: trans-retinoic acid
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: tretinoin
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: tretinoina
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: tretinoine
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: tretinoinum
database_cross_reference: WHO_MedNet
has synonym type: INN

Axiom
annotated source: all-trans-retinoic acid
annotated property: hasRelatedSynonym
annotated target: vitamin A acid
database_cross_reference: KEGG_COMPOUND

acrolein
type: Class
subclass of: CHEBI_51688

actinomycin
type: Class
subclass of: CHEBI_23239
definition: A large group of antibiotics isolated from various species of Streptomyces and characterised by having a substituted phenoxazine ring linked to two cyclic heterodetic peptides.
has alternative id: CHEBI:13723
has alternative id: CHEBI:22220
has alternative id: CHEBI:2445
database_cross_reference: CAS:1402-38-6
database_cross_reference: KEGG:C01775
has exact synonym: Actinomycin
has OBO namespace: chebi_ontology
has related synonym: actinomycins
id: CHEBI:15369
in subset: 3 STAR

Axiom
annotated source: actinomycin
annotated property: database_cross_reference
annotated target: CAS:1402-38-6
source: ChemIDplus

Axiom
annotated source: actinomycin
annotated property: database_cross_reference
annotated target: CAS:1402-38-6
source: KEGG COMPOUND

Axiom
annotated source: actinomycin
annotated property: has exact synonym
annotated target: Actinomycin
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: actinomycin
annotated property: hasRelatedSynonym
annotated target: actinomycins
database_cross_reference: ChEBI

water
type: Class
subclass of: dietary chemical component
subclass of: CHEBI_33693
subclass of: CHEBI_37176
subclass of: CHEBI_52625
subclass of: Restriction
  on property: has role
  some values from: CHEBI_48360
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75771
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75772
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76413
subclass of: Restriction
  on property: has role
  some values from: CHEBI_76971
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: is conjugate acid of
  some values from: CHEBI_16234
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_29412
definition: An oxygen hydride consisting of an oxygen atom that is covalently bonded to two hydrogen atoms
definition: An oxygen hydride consisting of an oxygen atom that is covalently bonded to two hydrogen atoms.
IAO_0000412: cdno.owl
charge: 0
formula: H2O
inchi: InChI=1S/H2O/h1H2
inchikey: XLYOFNOQVPJJNP-UHFFFAOYSA-N
mass: 18.01530
monoisotopicmass: 18.01056
smiles: [H]O[H]
has alternative id: CHEBI:10743
has alternative id: CHEBI:13352
has alternative id: CHEBI:27313
has alternative id: CHEBI:42043
has alternative id: CHEBI:42857
has alternative id: CHEBI:43228
has alternative id: CHEBI:44292
has alternative id: CHEBI:44701
has alternative id: CHEBI:44819
has alternative id: CHEBI:5585
database_cross_reference: Beilstein:3587155
database_cross_reference: CAS:7732-18-5
database_cross_reference: Gmelin:117
database_cross_reference: HMDB:HMDB0002111
database_cross_reference: KEGG:C00001
database_cross_reference: KEGG:D00001
database_cross_reference: MetaCyc:WATER
database_cross_reference: MolBase:1
database_cross_reference: PDBeChem:HOH
database_cross_reference: Reaxys:3587155
database_cross_reference: Wikipedia:Water
has exact synonym: WATER
has exact synonym: Water
has exact synonym: oxidane
has exact synonym: water
has OBO namespace: chebi_ontology
has related synonym: BOUND WATER
has related synonym: H2O
has related synonym: HOH
has related synonym: Wasser
has related synonym: [OH2]
has related synonym: acqua
has related synonym: agua
has related synonym: aqua
has related synonym: dihydridooxygen
has related synonym: dihydrogen oxide
has related synonym: eau
has related synonym: hydrogen hydroxide
id: CHEBI:15377
in subset: 3 STAR

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Beilstein:3587155
source: Beilstein

Beilstein
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Beilstein:3587155

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5
source: ChemIDplus

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5
source: KEGG COMPOUND

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5
source: NIST Chemistry WebBook

ChemIDplus
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5

KEGG COMPOUND
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5

NIST Chemistry WebBook
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: CAS:7732-18-5

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Gmelin:117
source: Gmelin

Gmelin
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Gmelin:117

Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Reaxys:3587155
source: Reaxys

Reaxys
type: Axiom
annotated source: water
annotated property: database_cross_reference
annotated target: Reaxys:3587155

Axiom
annotated source: water
annotated property: has exact synonym
annotated target: WATER
database_cross_reference: PDBeChem

Axiom
annotated source: water
annotated property: has exact synonym
annotated target: Water
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: water
annotated property: has exact synonym
annotated target: oxidane
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: water
annotated property: has exact synonym
annotated target: water
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: BOUND WATER
database_cross_reference: PDBeChem

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: H2O
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: H2O
database_cross_reference: UniProt

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: HOH
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: Wasser
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: [OH2]
database_cross_reference: IUPAC

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: acqua
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: agua
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: aqua
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: dihydridooxygen
database_cross_reference: IUPAC

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: dihydrogen oxide
database_cross_reference: IUPAC

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: eau
database_cross_reference: ChEBI

Axiom
annotated source: water
annotated property: hasRelatedSynonym
annotated target: hydrogen hydroxide
database_cross_reference: ChEBI

dioxygen
type: Class
subclass of: gas molecular entity
subclass of: CHEBI_25362
subclass of: CHEBI_33263
subclass of: Restriction
  on property: has role
  some values from: CHEBI_27027
subclass of: Restriction
  on property: has role
  some values from: CHEBI_33893
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35472
subclass of: Restriction
  on property: has role
  some values from: CHEBI_63248
subclass of: Restriction
  on property: has role
  some values from: CHEBI_75772
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77746
subclass of: Restriction
  on property: has role
  some values from: CHEBI_77974
subclass of: Restriction
  on property: is conjugate base of
  some values from: CHEBI_29793
charge: 0
formula: O2
inchi: InChI=1S/O2/c1-2
inchikey: MYMOFIZGZYHOMD-UHFFFAOYSA-N
mass: 31.998
monoisotopicmass: 31.98983
smiles: O=O
has alternative id: CHEBI:10745
has alternative id: CHEBI:13416
has alternative id: CHEBI:23833
has alternative id: CHEBI:25366
has alternative id: CHEBI:30491
has alternative id: CHEBI:44742
has alternative id: CHEBI:7860
database_cross_reference: CAS:7782-44-7
database_cross_reference: Gmelin:485
database_cross_reference: HMDB:HMDB0001377
database_cross_reference: KEGG:C00007
database_cross_reference: KEGG:D00003
database_cross_reference: MetaCyc:OXYGEN-MOLECULE
database_cross_reference: MolBase:750
database_cross_reference: PDBeChem:OXY
database_cross_reference: PMID:10906528
database_cross_reference: PMID:16977326
database_cross_reference: PMID:18210929
database_cross_reference: PMID:18638417
database_cross_reference: PMID:19840863
database_cross_reference: PMID:7710549
database_cross_reference: PMID:9463773
database_cross_reference: Wikipedia:Oxygen
has exact synonym: dioxygen
has OBO namespace: chebi_ontology
has related synonym: Disauerstoff
has related synonym: E 948
has related synonym: E-948
has related synonym: E948
has related synonym: O2
has related synonym: OXYGEN MOLECULE
has related synonym: Oxygen
has related synonym: [OO]
has related synonym: dioxygene
has related synonym: molecular oxygen
id: CHEBI:15379
in subset: 3 STAR

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: CAS:7782-44-7
source: ChemIDplus

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: CAS:7782-44-7
source: KEGG COMPOUND

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: CAS:7782-44-7
source: NIST Chemistry WebBook

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: Gmelin:485
source: Gmelin

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:10906528
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:16977326
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:18210929
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:18638417
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:19840863
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:7710549
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: database_cross_reference
annotated target: PMID:9463773
source: Europe PMC

Axiom
annotated source: dioxygen
annotated property: has exact synonym
annotated target: dioxygen
database_cross_reference: IUPAC
has synonym type: IUPAC NAME

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: Disauerstoff
database_cross_reference: ChEBI

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: E 948
database_cross_reference: ChEBI

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: E-948
database_cross_reference: ChEBI

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: E948
database_cross_reference: ChEBI

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: O2
database_cross_reference: IUPAC

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: O2
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: O2
database_cross_reference: UniProt

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: OXYGEN MOLECULE
database_cross_reference: PDBeChem

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: Oxygen
database_cross_reference: KEGG_COMPOUND

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: [OO]
database_cross_reference: MolBase

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: dioxygene
database_cross_reference: ChEBI

Axiom
annotated source: dioxygen
annotated property: hasRelatedSynonym
annotated target: molecular oxygen
database_cross_reference: ChEBI

(-)-ephedrine
type: Class
subclass of: CHEBI_25990
subclass of: CHEBI_38605
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35524
subclass of: Restriction
  on property: has role
  some values from: CHEBI_35703
subclass of: Restriction
  on property: has role
  some values from: CHEBI_50514
definition: A phenethylamine alkaloid that is 2-phenylethanamine substituted by a methyl group at the amino nitrogen and a methyl and a hydroxy group at position 2 and 1 respectively.
charge: 0
formula: C10H15NO
inchi: InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10-/m0/s1
inchikey: KWGRBVOPPLSCSI-WPRPVWTQSA-N
mass: 165.23220
monoisotopicmass: 165.11536
smiles: CN[C@@H](C)[C@H](O)c1ccccc1
has alternative id: CHEBI:10776
has alternative id: CHEBI:132176
has alternative id: CHEBI:18483
has alternative id: CHEBI:4801
database_cross_reference: CAS:299-42-3
database_cross_reference: Chemspider:4856
database_cross_reference: DrugBank:DB01364
database_cross_reference: Drug_Central:1024
database_cross_reference: Gmelin:261389
database_cross_reference: KEGG:C01575
database_cross_reference: KEGG:D00124
database_cross_reference: KNApSAcK:C00001409
database_cross_reference: PMID:13359219
database_cross_reference: PMID:13809594
database_cross_reference: PMID:21465337
database_cross_reference: PMID:25660335
database_cross_reference: PMID:27662264
database_cross_reference: PMID:27846433
database_cross_reference: Reaxys:2208730
database_cross_reference: VSDB:2959
database_cross_reference: Wikipedia:Ephedrine
has exact synonym: (-)-Ephedrine
has exact synonym: (1R,2S)-2-(methylamino)-1-phenylpropan-1-ol
has OBO namespace: chebi_ontology
has related synonym: (1R,2S)-1-phenyl-1-hydroxy-2-methylaminopropane
has related synonym: Ephedrine
has related synonym: L(-)-ephedrine
has related synonym: L-Ephedrine
has related synonym: L-erythro-2-(methylamino)-1-phenylpropan-1-ol
has related synonym: l-ephedrine
id: CHEBI:15407
in subset: 3 STAR