Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:50 UTC
Update Date2025-03-25 00:50:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180404
Frequency0.5
Structure
Chemical FormulaC14H19N2O+
Molecular Mass231.1492
SMILESC[N+]1(C)CC(O)CC1c1c[nH]c2ccccc12
InChI KeyZSTJRVOLMUCKKS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • aralkylamines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • pyrroles
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • indole
  • aralkylamine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organic cation
  • organic salt
  • pyrrolidine
  • alcohol
  • tetraalkylammonium salt
  • azacycle
  • n-alkylpyrrolidine
  • 1,2-aminoalcohol
  • quaternary ammonium salt
  • heteroaromatic compound
  • organic oxygen compound
  • pyrrole
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound