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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:30 UTC
Update Date2025-03-25 00:48:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168160
Frequency0.5
Structure
Chemical FormulaC6H13NO4
Molecular Mass163.0845
SMILESCC(N)(CC(=O)O)C(O)CO
InChI KeyHLSHPRRBNIEKMA-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
  • 1,2-diols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • methyl-branched fatty acids
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary alcohols
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • primary alcohol
  • 1,2-diol
  • alcohol
  • methyl-branched fatty acid
  • branched fatty acid
  • beta amino acid or derivatives
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound