Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:28:41 UTC
Update Date2025-03-21 20:56:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00410878
Frequency4.4
Structure
Chemical FormulaC4H7NO3
Molecular Mass117.0426
SMILESNCC(C=O)C(=O)O
InChI KeyIXURLVIGXZTUBX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • aldehydes
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • aldehyde
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound