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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:11 UTC
Update Date2025-03-21 18:00:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00024734
Frequency157.1
Structure
Chemical FormulaC7H12O6
Molecular Mass192.0634
SMILESCCOC(=O)C(O)C(O)C(O)C=O
InChI KeyOLPDIXSZRBRKFD-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
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • secondary alcohols
    • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • beta-hydroxy aldehyde
  • carbonyl group
  • monosaccharide
  • aldehyde
  • carboxylic acid derivative
  • fatty acid ester
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • monocarboxylic acid or derivatives
  • alpha-hydroxyaldehyde
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound