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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:53:54 UTC
Update Date2025-03-25 00:29:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02047585
Frequency0.6
Structure
Chemical FormulaC7H12N2O
Molecular Mass140.095
SMILESNC1CC2CCC(=O)N2C1
InChI KeyQEDWSRMQTAAACG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolizidines
Subclass pyrrolizidinones
Direct Parent pyrrolizidinones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • monoalkylamines
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • pyrrolizidinone
  • carbonyl group
  • lactam
  • azacycle
  • n-alkylpyrrolidine
  • carboxamide group
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • pyrrolidine
  • pyrrolidone
  • organooxygen compound