Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:27 UTC
Update Date2025-03-21 18:30:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082452
Frequency35.0
Structure
Chemical FormulaC15H14N2O
Molecular Mass238.1106
SMILESOc1ccc(NCc2c[nH]c3ccccc23)cc1
InChI KeyPOIZHZOQLMKRJO-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
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • phenylalkylamines
  • pyrroles
  • secondary alkylarylamines
  • Substituents
  • monocyclic benzene moiety
  • azacycle
  • indole
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • phenylalkylamine
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound