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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:23 UTC
Update Date2025-03-25 00:49:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177105
Frequency0.5
Structure
Chemical FormulaC19H21NO2
Molecular Mass295.1572
SMILESCOc1ccc2c(c1)-c1ccc(OC)cc1C1CN(C)CC21
InChI KeyWFAOIUFKDDAGDG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenanthrenes and derivatives
Subclass phenanthrenes and derivatives
Direct Parent phenanthrenes and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • hydrocarbon derivatives
  • isoindoles
  • isoindolines
  • n-alkylpyrrolidines
  • naphthalenes
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • phenol ether
  • ether
  • alkyl aryl ether
  • isoindoline
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • tertiary amine
  • organoheterocyclic compound
  • phenanthrene
  • azacycle
  • n-alkylpyrrolidine
  • isoindole
  • tertiary aliphatic amine
  • naphthalene
  • organic oxygen compound
  • anisole
  • isoindole or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound