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Record Information
HMDB Statusexpected
Creation Date2024-02-20 23:35:03 UTC
Update Date2025-03-21 17:56:51 UTC
HMDB IDHMDB0011602
Metabolite Identification
DeepMet IDDMID00003992
Name3-Oxoalanine
Frequency1436.4
Structure
Chemical FormulaC3H5NO3
Molecular Mass103.0269
SMILESNC(C=O)C(=O)O
InChI KeyXMTCKNXTTXDPJX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
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
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-dicarbonyl compound
  • organooxygen compound