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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:07 UTC
Update Date2025-03-25 01:00:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245057
Frequency0.5
Structure
Chemical FormulaC16H22N2O
Molecular Mass258.1732
SMILESCN1CCC23CCN(C)C2C1Cc1cccc(O)c13
InChI KeyUHFPCDZNSDEGIC-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
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • hydrocarbon derivatives
  • indoles
  • n-alkylpyrrolidines
  • organooxygen compounds
  • organopnictogen compounds
  • piperidines
  • tetralins
  • trialkylamines
  • Substituents
  • tetralin
  • azacycle
  • n-alkylpyrrolidine
  • indole
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • indole or derivatives
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • benzazocine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound