Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:28:56 UTC
Update Date2025-03-24 22:14:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01127516
Frequency1.2
Structure
Chemical FormulaC5H9NO3
Molecular Mass131.0582
SMILESCC(=O)C(O)C(=O)CN
InChI KeyGWNAMECGKBNEBE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyloins
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • saccharide
  • organic oxide
  • acyloin
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-diketone