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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:11:48 UTC
Update Date2025-03-21 23:10:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00655100
Frequency2.4
Structure
Chemical FormulaC4H5NO2
Molecular Mass99.032
SMILESCN1CC(=O)C1=O
InChI KeyKUMPTICFKIUBDJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass beta lactams
Direct Parent beta lactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
    • Substituents
  • carbonyl group
  • azacycle
  • cyclic ketone
  • carboxamide group
  • carboxylic acid derivative
  • ketone
  • azetidine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • beta-lactam
  • organooxygen compound