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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:47:38 UTC
Update Date2025-03-21 18:01:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00032863
Frequency110.9
Structure
Chemical FormulaC17H19NO3
Molecular Mass285.1365
SMILESCN1CCC23c4c5cc(O)cc4OC2C(O)C=CC3C1C5
InChI KeyNYEGIVLQKMKVGG-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
  • azacyclic compounds
  • coumarans
  • hydrocarbon derivatives
  • organopnictogen compounds
  • oxacyclic compounds
  • phenanthrenes and derivatives
  • piperidines
  • secondary alcohols
  • tetralins
  • trialkylamines
    • Substituents
  • tetralin
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • alcohol
  • phenanthrene
  • azacycle
  • tertiary aliphatic amine
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • morphinan
  • amine
  • organooxygen compound