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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:01 UTC
Update Date2025-03-25 00:58:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02228840
Frequency0.5
Structure
Chemical FormulaC8H15NO4
Molecular Mass189.1001
SMILESCC(=O)NC(CCCO)CC(=O)O
InChI KeyDNJSXSMAPNHHPA-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
  • acetamides
  • alcohols and polyols
  • amino fatty acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • medium-chain hydroxy acids and derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • carboxamide group
  • amino fatty acid
  • medium-chain hydroxy acid
  • beta amino acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • medium-chain fatty acid
  • hydroxy fatty acid
  • organic nitrogen compound
  • acetamide
  • organooxygen compound