Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:59 UTC
Update Date2025-03-21 18:32:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00093201
Frequency30.0
Structure
Chemical FormulaC18H18N2
Molecular Mass262.147
SMILESc1ccc(CC2NCCc3c2[nH]c2ccccc32)cc1
InChI KeyLHVNPTMRAQQPID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassalkaloids and derivatives
Classharmala alkaloids
Subclass harmala alkaloids
Direct Parent harmala alkaloids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • beta carbolines
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • azacycle
  • indole
  • heteroaromatic compound
  • harman
  • indole or derivatives
  • secondary amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • beta-carboline
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organoheterocyclic compound
  • pyridoindole
  • amine