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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:29:33 UTC
Update Date2025-03-21 18:41:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00133052
Frequency19.0
Structure
Chemical FormulaC17H23NO4S
Molecular Mass337.1348
SMILESCN1CCC23CCCCC2C1Cc1ccc(OS(=O)(=O)O)cc13
InChI KeyWVXRTBLFQVXOLU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassalkaloids and derivatives
Classmorphinans
Subclass morphinans
Direct Parent morphinans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • arylsulfates
  • azacyclic compounds
  • benzazocines
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • phenanthrenes and derivatives
  • piperidines
  • sulfuric acid monoesters
  • tetralins
  • trialkylamines
    • Substituents
  • tetralin
  • sulfuric acid monoester
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • arylsulfate
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • phenanthrene
  • organic sulfuric acid or derivatives
  • azacycle
  • tertiary aliphatic amine
  • organic oxygen compound
  • benzazocine
  • sulfate-ester
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • sulfuric acid ester
  • morphinan
  • amine
  • organooxygen compound