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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:18:16 UTC
Update Date2025-03-25 01:00:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02243030
Frequency0.5
Structure
Chemical FormulaC16H15NO2
Molecular Mass253.1103
SMILESC=CC1=C(C)C(C=CC(=O)c2ccccc2)NC1=O
InChI KeyGLNRCSKGWOPPFV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoyl derivatives
Direct Parent benzoyl derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alpha,beta-unsaturated ketones
  • aryl ketones
  • azacyclic compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolines
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • azacycle
  • benzoyl
  • alpha,beta-unsaturated ketone
  • carboxamide group
  • carboxylic acid derivative
  • ketone
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • aryl ketone