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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:56 UTC
Update Date2025-03-21 18:39:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124488
Frequency20.7
Structure
Chemical FormulaC29H34N2O3
Molecular Mass458.2569
SMILESCN(C)C(=O)C(CCN1CCC(O)(c2ccc(O)cc2)CC1)(c1ccccc1)c1ccccc1
InChI KeyLTMDSEWWMRPJPZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acyl amines
  • organic oxides
  • organopnictogen compounds
  • phenylacetamides
  • phenylpiperidines
  • tertiary alcohols
  • tertiary carboxylic acid amides
  • trialkylamines
  • Substituents
  • diphenylmethane
  • carbonyl group
  • aromatic heteromonocyclic compound
  • amino acid or derivatives
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • phenylacetamide
  • tertiary amine
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • carboxamide group
  • n-acyl-amine
  • tertiary alcohol
  • organic oxygen compound
  • phenylpiperidine
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound