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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:03 UTC
Update Date2025-03-25 00:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222289
Frequency0.5
Structure
Chemical FormulaC26H29NO2
Molecular Mass387.2198
SMILESOCc1ccccc1CN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1
InChI KeyTZYBOUBUKVOYGP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass benzylpiperidines
Direct Parent n-benzylpiperidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aralkylamines
  • aromatic alcohols
  • azacyclic compounds
  • benzyl alcohols
  • benzylamines
  • diphenylmethanes
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylmethylamines
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • diphenylmethane
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • aralkylamine
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • benzyl alcohol
  • n-benzylpiperidine
  • tertiary alcohol
  • phenylmethylamine
  • organic oxygen compound
  • benzylamine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound