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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:37 UTC
Update Date2025-03-25 00:56:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02216603
Frequency0.5
Structure
Chemical FormulaC15H16N2O2
Molecular Mass256.1212
SMILESCCC1C(=O)NC(Cc2c[nH]c3ccccc23)C1=O
InChI KeyPLBKBLZYDXOSMW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • azacyclic compounds
  • benzenoids
  • carboxylic acids and derivatives
  • cyclic ketones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • pyrrolidine-2-ones
  • pyrrolidine-3-ones
  • secondary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • 3-pyrrolidone
  • indole
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrrole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound