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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:43:35 UTC
Update Date2025-03-21 17:59:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00023324
Frequency168.7
Structure
Chemical FormulaC17H23NO
Molecular Mass257.178
SMILESCOc1ccc2c(c1)C13CCCCC1C(C2)N(C)C3
InChI KeyWIEXIXSAAAUMMG-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
  • azepines
  • benzazepines
  • hydrocarbon derivatives
  • isoindoles
  • isoindolines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • tetralins
  • trialkylamines
  • Substituents
  • tetralin
  • 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
  • organic oxygen compound
  • azepine
  • anisole
  • isoindole or derivatives
  • hydrocarbon derivative
  • organic nitrogen compound
  • benzazepine
  • amine
  • organooxygen compound