Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:58 UTC
Update Date2025-03-25 00:46:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155742
Frequency0.5
Structure
Chemical FormulaC9H9NOS
Molecular Mass179.0405
SMILESCSc1c[nH]c2c(O)cccc12
InChI KeyZSUABOGMYACGCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkylarylthioethers
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrroles
  • sulfenyl compounds
  • Substituents
  • sulfenyl compound
  • azacycle
  • indole
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • thioether
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound