Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:22 UTC
Update Date2025-03-21 18:33:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096498
Frequency28.6
Structure
Chemical FormulaC7H8O2S
Molecular Mass156.0245
SMILESCc1ccsc1CC(=O)O
InChI KeyYTGJNMDKPCCOOT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classheteroaromatic compounds
Subclass heteroaromatic compounds
Direct Parent heteroaromatic compounds
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • thiophenes
  • Substituents
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • thiophene
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound