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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:10 UTC
Update Date2025-03-21 18:36:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00110759
Frequency24.0
Structure
Chemical FormulaC7H9NO2S
Molecular Mass171.0354
SMILESCOC(=O)Cc1scnc1C
InChI KeyWQYUGFQXZGZRSD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass thiazoles
Direct Parent 4,5-disubstituted thiazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • carboxylic acid derivative
  • 4,5-disubstituted 1,3-thiazole
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound