Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:28:00 UTC
Update Date2025-03-24 21:38:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01843773
Frequency0.7
Structure
Chemical FormulaC4H5NO2
Molecular Mass99.032
SMILESO=CC1CC(=O)N1
InChI KeyKQLYGALWBRSYQB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass beta lactams
Direct Parent monobactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aldehydes
  • azacyclic compounds
  • azetidines
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • azacycle
  • monobactam
  • aldehyde
  • carboxamide group
  • carboxylic acid derivative
  • azetidine
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound