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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:17 UTC
Update Date2025-03-21 18:36:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108608
Frequency24.7
Structure
Chemical FormulaC6H13NO4
Molecular Mass163.0845
SMILESCN(C)CC(O)C(O)C(=O)O
InChI KeyLEUMPNRUBXEAQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • 1,2-diols
  • 1,3-aminoalcohols
  • alpha hydroxy acids and derivatives
  • amino acids
  • amino fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organopnictogen compounds
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • trialkylamines
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • amino acid or derivatives
  • amino acid
  • alpha-hydroxy acid
  • monosaccharide
  • fatty acid
  • carboxylic acid derivative
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydroxy fatty acid
  • tertiary amine
  • 1,2-diol
  • alcohol
  • 1,3-aminoalcohol
  • 1,2-aminoalcohol
  • tertiary aliphatic amine
  • amino fatty acid
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound