Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:22 UTC
Update Date2025-03-25 00:45:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151979
Frequency0.5
Structure
Chemical FormulaC6H7NO2S
Molecular Mass157.0197
SMILESNC(=O)c1ccsc1CO
InChI KeyJXOHAWFNTQBFRC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiophenes
Subclass thiophene carboxylic acids and derivatives
Direct Parent thiophene carboxamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • aromatic alcohol
  • primary carboxylic acid amide
  • alcohol
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • carboxamide group
  • carboxylic acid derivative
  • thiophene carboxamide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound