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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:02:36 UTC
Update Date2025-03-24 20:08:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01353410
Frequency1.0
Structure
Chemical FormulaC7H9NO2
Molecular Mass139.0633
SMILESO=C1CC2CCCN2C1=O
InChI KeyMWIHAFYKWVLNEV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizidines
Subclass pyrrolizidinones
Direct Parent pyrrolizidinones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • pyrrolidine-3-ones
  • tertiary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • 3-pyrrolidone
  • cyclic ketone
  • carboxylic acid derivative
  • ketone
  • aliphatic heteropolycyclic compound
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • pyrrolizidinone
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound