Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:51 UTC
Update Date2025-03-21 17:58:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012847
Frequency352.0
Structure
Chemical FormulaC4H7NO4
Molecular Mass133.0375
SMILESCOC(=O)C(N)C(=O)O
InChI KeyDJJDVURDQUREHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • alpha amino acids
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • methyl esters
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-amino acid ester
  • organic oxide
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • alpha-amino acid
  • dicarboxylic acid or derivatives
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound