Validation Log 2025-12-14 23:39:50.881608 mwtab Python Library Version: 2.0.0 Source: https://www.metabolomicsworkbench.org/rest/study/analysis_id/AN002832/mwtab/txt Study ID: ST001739 Analysis ID: AN002832 File format: txt Status: Contains Validation Issues Number of Issues: 16 Number of Warnings: 10 Number of Value Errors: 15 Number of Consistency Errors: 0 Number of Format Errors: 1 Issue Log: Error: The value, "Male and female", for the subsection, "GENDER", in the "SUBJECT" section should be one of "Male", "Female", "Male, Female", "Hermaphrodite", or "N/A". Ignore this when more complicated descriptions are required. Error: The value, "once", for the subsection, "TREATMENT_DOSEDURATION", in the "TREATMENT" section should be a number or range (ex. "5-6") followed by a space with a unit (ex. "5 V") from the following list: ['h', 'weeks', 'days']. Ignore this when more complicated descriptions are required. Error: The value, "300ul/min", for the subsection, "FLOW_RATE", in the "CHROMATOGRAPHY" section should be a number or range (ex. "5-6") followed by a space with a unit (ex. "5 V") from the following list: ['mL/min', 'uL/min', 'μL/min']. Ignore this when more complicated descriptions are required. Error: The value, "40", for the subsection, "COLUMN_TEMPERATURE", in the "CHROMATOGRAPHY" section should be a number or range (ex. "5-6") followed by a space with a unit (ex. "5 V") from the following list: ['°C', 'C']. Ignore this when more complicated descriptions are required. Error: The value, "20min", for the subsection, "ANALYTICAL_TIME", in the "CHROMATOGRAPHY" section should be a number or range (ex. "5-6") followed by a space with a unit (ex. "5 V") from the following list: ['min']. Ignore this when more complicated descriptions are required. Error: The required property, "FLOW_GRADIENT", in the "CHROMATOGRAPHY" section is missing. Warning: The "Molecular Weight" column at position 6 in the METABOLITES table, matches a standard column name, "mass". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "InChIKey" column at position 4 in the METABOLITES table, matches a standard column name, "inchi_key". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "InChIKey" column at position 4 in the METABOLITES table, matches a standard column name, "inchi_key", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 0 1 254 YDYFVUFSPQPPV-PEXOCOHZSA-N Warning: The "Formula" column at position 5 in the METABOLITES table, matches a standard column name, "formula", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 0 1 6 C7 H13 N O3 S2 8 C11 H21 N O5 15 C18 H31 N O4 17 C11 H23 N O2 27 C4 H7 N O2 28 C28 H50 N O7 P 29 C21 H44 N O7 P 31 C23 H48 N O7 P 32 C6 H15 N O2 36 C8 H9 N O 39 C7 H11 N O 41 C13 H23 N O4 42 C8 H13 N O4 45 C10 H19 N O3 49 C21 H37 N O4 56 C21 H41 N O5 66 C9 H7 N O 68 C5 H7 N O3 69 C7 H15 N O2 77 C4 H7 N O3 82 H3 N O3 S 93 C18 H31 N O4 96 C20 H41 N O3 98 C17 H19 Cl N2 S 100 C5 H13 N O 102 C12 H9 N S 104 C11 H11 N O3 106 C21 H39 N O4 109 C18 H19 Cl N4 110 C18 H19 Cl N4 O 115 C7 H11 N O4 S 119 C14 H17 N O9 123 C20 H35 N O2 127 C5 H9 N O4 133 C5 H9 N O2 134 C9 H15 N O3 139 C6 H13 N O3 155 C26 H43 N O6 159 C6 H13 N O 160 C8 H15 N O3 161 C9 H9 N O3 165 C11 H9 N O2 166 C11 H11 N O3 167 C8 H7 N O4 S 168 C6 H11 N O3 171 C9 H17 N O4 174 C7 H15 N O3 181 C5 H11 N O2 S 184 C9 H11 N O2 186 C3 H7 N O3 187 C4 H9 N O3 188 C9 H11 N O3 191 C5 H11 N O2 192 C26 H52 N O7 P 193 C24 H48 N O7 P 194 C26 H50 N O7 P 195 C28 H48 N O7 P 196 C30 H52 N O7 P 197 C24 H50 N O6 P 198 C26 H54 N O6 P 199 C23 H46 N O7 P 200 C25 H44 N O7 P 204 C8 H17 N O2 207 C11 H17 N O 215 C5 H9 N O3 216 C11 H13 N O3 217 C11 H13 N O4 218 C5 H9 N O4 219 C4 H9 N O4 S 221 C6 H5 N O2 222 C7 H13 N O3 223 C27 H45 N O4 224 C18 H37 N O 227 C18 H35 N O 230 C20 H39 N O2 237 C16 H33 N O 239 C18 H37 N O2 242 C45 H78 N O8 P 245 C10 H11 N O3 251 C6 H11 N O2 252 C9 H17 N O3 253 C26 H54 N O7 P 255 C8 H17 N O2 258 C5 H9 N O2 259 C7 H13 N O2 260 C17 H20 N2 O S 261 C17 H20 N2 O S 262 C10 H19 N O4 266 C38 H72 N O10 P 275 C23 H27 F N4 O2 276 C6 H10 O S 277 C13 H21 N O3 279 C9 H9 N O4 280 C6 H11 N O2 S 286 C18 H40 N O5 P 287 C18 H38 N O5 P 288 C25 H49 N O4 292 C26 H43 N O7 S 294 C2 H7 N O3 S 300 C5 H9 N O2 S 304 C12 H21 N O4 305 C11 H13 N O3 306 C8 H15 N O2 307 C19 H35 N O4 308 C23 H43 N O4 313 C2 H F3 O2 314 C6 H9 N O3 315 C41 H67 N O15 316 C53 H87 N O19 319 C13 H23 N O3 320 C5 H11 N O2 322 C6 H11 N O2 Warning: The "KEGG" column at position 3 in the METABOLITES table, matches a standard column name, "kegg_id". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "KEGG" column at position 3 in the METABOLITES table, matches a standard column name, "kegg_id", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 0 1 Warning: The "Human Metabolome Database" column at position 2 in the METABOLITES table, matches a standard column name, "hmdb_id". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "Human Metabolome Database" column at position 2 in the METABOLITES table, matches a standard column name, "hmdb_id", and some of the values in the column do not match the expected type or format for that column. The non-matching values are: 0 1 Warning: The "RT [min]" column at position 7 in the METABOLITES table, matches a standard column name, "retention_time". If this match was not in error, the column should be renamed to the standard name or a name that doesn't resemble the standard name. Warning: The "mzCloud Library Match: Autoprocessed" column at position 9 in the METABOLITES table may have incorrect values. 90% or more of the values are the same, but 10% or less are different.