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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:56 UTC
Update Date2025-03-21 17:58:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00015280
Frequency285.1
Structure
Chemical FormulaC6H8O6
Molecular Mass176.0321
SMILESCC(=O)C(O)(CC(=O)O)C(=O)O
InChI KeyCNIYVXIHYMFTCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass gamma-keto acids and derivatives
Direct Parent gamma-keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyloins
  • alpha hydroxy acids and derivatives
  • alpha-hydroxy ketones
  • beta-hydroxy ketones
  • beta-keto acids and derivatives
  • branched fatty acids
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • organic oxides
  • short-chain keto acids and derivatives
  • tertiary alcohols
  • Substituents
  • fatty acyl
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • short-chain keto acid
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • beta-keto acid
  • ketone
  • organic oxide
  • hydroxy fatty acid
  • alcohol
  • hydroxy acid
  • branched fatty acid
  • gamma-keto acid
  • tertiary alcohol
  • organic oxygen compound
  • acyloin
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound