Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:41 UTC
Update Date2025-03-25 00:48:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02170873
Frequency0.5
Structure
Chemical FormulaC18H20N2
Molecular Mass264.1626
SMILESCNCCc1cn(Cc2ccccc2)c2ccccc12
InChI KeyYRMXRPUPYQTPJG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass n-alkylindoles
Direct Parent n-alkylindoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organopnictogen compounds
  • substituted pyrroles
  • Substituents
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • n-alkylindole
  • azacycle
  • indole
  • heteroaromatic compound
  • substituted pyrrole
  • secondary amine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine