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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:11 UTC
Update Date2025-03-25 00:49:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176652
Frequency0.5
Structure
Chemical FormulaC30H31NO3
Molecular Mass453.2304
SMILESOc1ccc2cc(C(O)CN3CCC(C(O)(c4ccccc4)c4ccccc4)CC3)ccc2c1
InChI KeyNCHNTPVYWMWZMT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • 1-hydroxy-2-unsubstituted benzenoids
  • aromatic alcohols
  • azacyclic compounds
  • hydrocarbon derivatives
  • naphthols and derivatives
  • organopnictogen compounds
  • piperidines
  • secondary alcohols
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • diphenylmethane
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • 2-naphthol
  • tertiary amine
  • organoheterocyclic compound
  • alcohol
  • azacycle
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • tertiary alcohol
  • naphthalene
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound