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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:05:21 UTC
Update Date2025-03-24 21:28:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01789891
Frequency0.7
Structure
Chemical FormulaC5H9NO2
Molecular Mass115.0633
SMILESCN1CC(C)(O)C1=O
InChI KeyFDWFPXLJUHBRAH-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
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary alcohols
  • tertiary carboxylic acid amides
    • Substituents
  • alcohol
  • carbonyl group
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • azetidine
  • tertiary alcohol
  • 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