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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:07 UTC
Update Date2025-03-21 18:41:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134301
Frequency18.7
Structure
Chemical FormulaC10H16O9
Molecular Mass280.0794
SMILESCC1OC(OC(=O)C(O)C(O)C=O)C(O)C(O)C1O
InChI KeyHTGBRHBAXCIXNJ-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 heteromonocyclic compounds
Alternative Parents
  • acetals
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
    • Substituents
  • fatty acyl
  • beta-hydroxy aldehyde
  • carbonyl group
  • monosaccharide
  • carboxylic acid derivative
  • beta-hydroxy acid
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • acetal
  • aliphatic heteromonocyclic compound
  • oxane
  • organoheterocyclic compound
  • alcohol
  • aldehyde
  • oxacycle
  • fatty acid ester
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound