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Record Information
HMDB Statusdetected
Creation Date2024-02-21 00:24:34 UTC
Update Date2025-03-21 18:38:32 UTC
HMDB IDHMDB0243839
Metabolite Identification
DeepMet IDDMID00121313
Name1-Benzylpiperidine-4-carboxylic acid
Frequency21.4
Structure
Chemical FormulaC13H17NO2
Molecular Mass219.1259
SMILESO=C(O)C1CCN(Cc2ccccc2)CC1
InChI KeyZMVSVQMWFTZSJQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpiperidines
Subclass benzylpiperidines
Direct Parent n-benzylpiperidines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • amino acids
  • aralkylamines
  • azacyclic compounds
  • benzylamines
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • phenylmethylamines
  • piperidinecarboxylic acids
  • trialkylamines
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • amino acid
  • carboxylic acid derivative
  • aralkylamine
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • piperidinecarboxylic acid
  • tertiary amine
  • azacycle
  • tertiary aliphatic amine
  • n-benzylpiperidine
  • monocarboxylic acid or derivatives
  • phenylmethylamine
  • organic oxygen compound
  • benzylamine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound