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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:16 UTC
Update Date2025-03-25 00:49:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172214
Frequency0.5
Structure
Chemical FormulaC16H21NO2
Molecular Mass259.1572
SMILESCN1CCC23c4cc(O)ccc4CC1C2CCC3O
InChI KeySYRWCMUOXRFICJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzazocines
Direct Parent benzazocines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • secondary alcohols
  • tetralins
  • trialkylamines
  • Substituents
  • alcohol
  • tetralin
  • azacycle
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic alcohol
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • benzazocine
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound