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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:46 UTC
Update Date2025-03-21 18:01:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00030782
Frequency120.5
Structure
Chemical FormulaC18H25NO2
Molecular Mass287.1885
SMILESCOc1cc2c(cc1O)CC1C3CCCCC23CCN1C
InChI KeyQTZSTTATLWGBRP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassalkaloids and derivatives
Classmorphinans
Subclass morphinans
Direct Parent morphinans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • benzazocines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • phenanthrenes and derivatives
  • piperidines
  • tetralins
  • trialkylamines
    • Substituents
  • tetralin
  • phenol ether
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • phenanthrene
  • azacycle
  • tertiary aliphatic amine
  • organic oxygen compound
  • anisole
  • benzazocine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • morphinan
  • amine
  • organooxygen compound