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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:50 UTC
Update Date2025-03-21 18:34:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00100103
Frequency27.4
Structure
Chemical FormulaC14H19N3O
Molecular Mass245.1528
SMILESC=CC1CN2CCC1CC2C(O)c1cnccn1
InChI KeyNKSJDUMQXQWBOF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinuclidines
Subclass quinuclidines
Direct Parent quinuclidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • pyrazines
  • secondary alcohols
  • trialkylamines
    • Substituents
  • aromatic alcohol
  • alcohol
  • azacycle
  • 1,2-aminoalcohol
  • quinuclidine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organooxygen compound