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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:01 UTC
Update Date2025-03-25 00:51:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189963
Frequency0.5
Structure
Chemical FormulaC17H21N3O2
Molecular Mass299.1634
SMILESC=CC1CN2CCC1CC2C(O)c1cccc2[nH]c(=O)[nH]c12
InChI KeyRFWDCNCZLIWKME-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzimidazoles
Subclass benzimidazoles
Direct Parent benzimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • piperidines
  • quinuclidines
  • secondary alcohols
  • trialkylamines
    • Substituents
  • aromatic alcohol
  • quinuclidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • benzimidazole
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • tertiary amine
  • azole
  • alcohol
  • carbonic acid derivative
  • azacycle
  • 1,2-aminoalcohol
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound