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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:43 UTC
Update Date2025-03-21 18:38:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00119345
Frequency21.8
Structure
Chemical FormulaC32H41NO3
Molecular Mass487.3086
SMILESCC(C)(CO)c1ccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1
InChI KeyZIQKFOOBIMENJF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenylbutylamines
  • phenylpropanes
  • piperidines
  • secondary alcohols
  • tertiary alcohols
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • alcohol
  • diphenylmethane
  • aromatic heteromonocyclic compound
  • azacycle
  • tertiary aliphatic amine
  • phenylpropane
  • tertiary alcohol
  • phenylbutylamine
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound