Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:58:34 UTC
Update Date2025-03-21 22:02:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00481689
Frequency3.6
Structure
Chemical FormulaC4H7NO2
Molecular Mass101.0477
SMILESCN1CC(O)C1=O
InChI KeyPBMHLTRFOJIZSG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass beta lactams
Direct Parent monobactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • azetidines
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • alcohol
  • carbonyl group
  • azacycle
  • monobactam
  • carboxamide group
  • carboxylic acid derivative
  • azetidine
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound