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Record Information
HMDB Statusdetected
Creation Date2024-02-21 15:12:53 UTC
Update Date2025-03-25 00:58:26 UTC
HMDB IDHMDB0251064
Metabolite Identification
DeepMet IDDMID02230731
NameDesomorphine
Frequency0.5
Structure
Chemical FormulaC17H21NO2
Molecular Mass271.1572
SMILESCN1CCC23c4c5ccc(O)c4OC2CCCC3C1C5
InChI KeyLNNWVNGFPYWNQE-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
  • tetralins
  • trialkylamines
    • Substituents
  • tetralin
  • phenanthrene
  • ether
  • azacycle
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • piperidine
  • morphinan
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • organooxygen compound