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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:28 UTC
Update Date2025-03-25 01:01:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02250485
Frequency0.5
Structure
Chemical FormulaC14H15NO
Molecular Mass213.1154
SMILESO=C1Nc2ccccc2C23CCCCC2C13
InChI KeyTWWVAFVGAFREGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzazepines
Subclass benzazepines
Direct Parent benzazepines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • azepines
  • benzenoids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroquinolines
  • hydroquinolones
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
    • Substituents
  • quinolone
  • tetrahydroquinolone
  • carbonyl group
  • lactam
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • azepine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • benzazepine
  • tetrahydroquinoline
  • organooxygen compound