Validation Log 2025-12-15 03:07:38.381825 mwtab Python Library Version: 2.0.0 Source: https://www.metabolomicsworkbench.org/rest/study/analysis_id/AN006589/mwtab/txt Study ID: ST003998 Analysis ID: AN006589 File format: txt Status: Contains Validation Issues Number of Issues: 10 Number of Warnings: 5 Number of Value Errors: 9 Number of Consistency Errors: 0 Number of Format Errors: 1 Issue Log: Error: An empty value or a null value was detected for the subsection, "FLOW_GRADIENT", in the "CHROMATOGRAPHY" section. A legitimate value should be provided for this required subsection. Error: The value 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: An empty value or a null value was detected for the subsection, "SOLVENT_A", in the "CHROMATOGRAPHY" section. A legitimate value should be provided for this required subsection. Error: An empty value or a null value was detected for the subsection, "SOLVENT_B", in the "CHROMATOGRAPHY" section. A legitimate value should be provided for this required subsection. Error: Unknown or invalid section, "FACTORS". Warning: The "NIST Theo. Mol. Mass" column at position 4 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 "NIST Lib Hit Formula" column at position 3 in the METABOLITES table, matches a standard column name, "formula". 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 "NIST Lib Hit Formula" column at position 3 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: 2 C14 H37 N O Si3 6 C13 H33 N O2 Si3 7 C17 H37 N O3 Si2 8 C14 H35 N O2 Si3 10 C20 H35 F3 N2 O Si3 14 C18 H35 N O3 Si3 22 C11 H29 N O2 Si3 25 C14 H33 N O4 Si3 29 C11 H27 N O2 Si2 35 C17 H35 N O Si3 Warning: The "Pubchem CID" column at position 5 in the METABOLITES table, matches a standard column name, "pubchem_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 "RT [min]" column at position 2 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.