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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:27 UTC
Update Date2025-03-25 00:46:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154563
Frequency0.5
Structure
Chemical FormulaC20H25NO2
Molecular Mass311.1885
SMILESCOc1ccc(C(c2ccccc2)C2CCCN2C)cc1OC
InChI KeySNALBVALAXQBMG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • phenoxy compounds
  • trialkylamines
  • Substituents
  • diphenylmethane
  • phenol ether
  • ether
  • aromatic heteromonocyclic compound
  • alkyl aryl ether
  • dimethoxybenzene
  • o-dimethoxybenzene
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • organoheterocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • methoxybenzene
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • organooxygen compound