Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:47:35 UTC
Update Date2025-03-21 18:01:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00032730
Frequency111.4
Structure
Chemical FormulaC15H18N2O3
Molecular Mass274.1317
SMILESOC1C=CC(NCc2c[nH]c3ccccc23)C(O)C1O
InChI KeyJLQXDOFUTBINQZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • cyclitols and derivatives
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • indole
  • heteroaromatic compound
  • cyclitol or derivatives
  • secondary amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • amine