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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:53 UTC
Update Date2025-03-25 00:58:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230723
Frequency0.5
Structure
Chemical FormulaC15H21N
Molecular Mass215.1674
SMILESCN1CCC2c3ccccc3CC1C2(C)C
InChI KeyGAPAQANHXWWCQD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassalkaloids and derivatives
Class6,7-benzomorphans
Subclass 6,7-benzomorphans
Direct Parent 6,7-benzomorphans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzazocines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • tetralins
  • trialkylamines
    • Substituents
  • tetralin
  • azacycle
  • tertiary aliphatic amine
  • aromatic heteropolycyclic compound
  • benzazocine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine
  • organoheterocyclic compound
  • 6,7-benzomorphan