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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:34 UTC
Update Date2025-03-25 00:45:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150104
Frequency0.5
Structure
Chemical FormulaC11H19NO4
Molecular Mass229.1314
SMILESCC(C)CCC(=O)NCCCC(=O)C(=O)O
InChI KeyOABSMYNAZQZGND-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass short-chain keto acids and derivatives
Direct Parent short-chain keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • branched fatty acids
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • short-chain keto acid
  • carboxamide group
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • branched fatty acid
  • n-acyl-amine
  • ketone
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • alpha-keto acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound