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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:33 UTC
Update Date2025-03-21 18:38:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121267
Frequency21.4
Structure
Chemical FormulaC7H10O7
Molecular Mass206.0427
SMILESCC(=O)OC(=O)CC(O)C(O)C(=O)O
InChI KeyHVDTXOOMUOEYAV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tricarboxylic acids and derivatives
Direct Parent tricarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • alpha hydroxy acids and derivatives
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid anhydrides
  • carboxylic acids
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • monosaccharide
  • tricarboxylic acid or derivatives
  • hydroxy acid
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound
  • 1,2-diol