Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:38 UTC
Update Date2025-03-25 00:47:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159393
Frequency0.5
Structure
Chemical FormulaC10H11NO4S
Molecular Mass241.0409
SMILESO=S(=O)(CCO)Oc1ccc2cc[nH]c2c1
InChI KeyGGAODHZIEPCHNY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alcohols and polyols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfonic acid esters
  • pyrroles
  • sulfonic acid esters
  • sulfonyls
  • Substituents
  • alcohol
  • organosulfonic acid or derivatives
  • azacycle
  • indole
  • heteroaromatic compound
  • organosulfur compound
  • organosulfonic acid ester
  • sulfonic acid ester
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organic sulfonic acid or derivatives
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound