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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:15 UTC
Update Date2025-03-21 18:35:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00106025
Frequency25.4
Structure
Chemical FormulaC16H20N2O
Molecular Mass256.1576
SMILESOC(c1c[nH]c2ccccc12)C1CC2CCN1CC2
InChI KeyXOWANQGOKRYHPS-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
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • pyrroles
  • quinuclidines
  • secondary alcohols
  • trialkylamines
    • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • 1,2-aminoalcohol
  • indole
  • quinuclidine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organooxygen compound