Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:49 UTC
Update Date2025-03-25 00:59:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02237439
Frequency0.5
Structure
Chemical FormulaC11H14N2O3
Molecular Mass222.1004
SMILESNc1ccc2[nH]cc(C(O)C(O)CO)c2c1
InChI KeyQPBPNRXDBXBZBK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
  • primary amines
  • pyrroles
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • indole
  • heteroaromatic compound
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • primary alcohol
  • amine
  • organooxygen compound