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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:16 UTC
Update Date2025-03-21 18:28:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072357
Frequency41.3
Structure
Chemical FormulaC22H28N2O3
Molecular Mass368.21
SMILESNC(CCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)C(=O)O
InChI KeyJDFDWXJRQZHTRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • amino acids
  • amino fatty acids
  • aromatic alcohols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • piperidines
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • fatty acyl
  • diphenylmethane
  • carbonyl group
  • carboxylic acid
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • amino acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydroxy fatty acid
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • amino fatty acid
  • tertiary alcohol
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • amine
  • organooxygen compound