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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:30 UTC
Update Date2025-03-21 18:36:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109129
Frequency24.5
Structure
Chemical FormulaC10H9NO2
Molecular Mass175.0633
SMILESCC1C(=O)Nc2ccccc2C1=O
InChI KeyFWXMNRBUPWKVAX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent hydroquinolones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • aryl alkyl ketones
  • azacyclic compounds
  • benzenoids
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroquinolines
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • carbonyl group
  • lactam
  • aryl alkyl ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • tetrahydroquinoline
  • vinylogous amide
  • tetrahydroquinolone
  • azacycle
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound
  • aryl ketone