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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:57:26 UTC
Update Date2025-03-21 18:05:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00056071
Frequency56.9
Structure
Chemical FormulaC5H11NO3
Molecular Mass133.0739
SMILESCC(O)(CN)CC(=O)O
InChI KeyHPWNGDFGOGOKCN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent gamma amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • methyl-branched fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • short-chain hydroxy acids and derivatives
  • tertiary alcohols
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • short-chain hydroxy acid
  • gamma amino acid or derivatives
  • fatty acid
  • branched fatty acid
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • hydroxy fatty acid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound