Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:28:34 UTC
Update Date2025-03-24 14:20:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00839419
Frequency1.8
Structure
Chemical FormulaC6H9NO2
Molecular Mass127.0633
SMILESCC1CCC(=O)N1C=O
InChI KeyQUSZXBPHHVOEOM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent n-substituted carboxylic acid imides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidine-2-ones
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • azacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • pyrrolidine
  • carboxylic acid imide, n-substituted
  • pyrrolidone
  • organoheterocyclic compound
  • organooxygen compound