Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:08 UTC
Update Date2025-03-21 18:38:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00120272
Frequency21.6
Structure
Chemical FormulaC12H14N2O
Molecular Mass202.1106
SMILESOC1CNC(c2c[nH]c3ccccc23)C1
InChI KeyCVDDAOBOKLPQPW-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
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • pyrrolidines
  • secondary alcohols
  • Substituents
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • indole
  • heteroaromatic compound
  • secondary amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • pyrrolidine
  • organooxygen compound
  • amine