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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:19 UTC
Update Date2025-03-21 18:36:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111134
Frequency23.9
Structure
Chemical FormulaC7H10O8S
Molecular Mass254.0096
SMILESCS(=O)(=O)OC1=C(O)C(=O)OC1C(O)CO
InChI KeyJUXLOYJYCONSIE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass furanones
Direct Parent butenolides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • dihydrofurans
  • enoate esters
  • hydrocarbon derivatives
  • lactones
  • methanesulfonates
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organosulfonic acid esters
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • sulfonic acid esters
  • sulfonyls
    • Substituents
  • organosulfonic acid or derivatives
  • carbonyl group
  • monosaccharide
  • organosulfur compound
  • carboxylic acid derivative
  • lactone
  • sulfonic acid ester
  • alpha,beta-unsaturated carboxylic ester
  • 2-furanone
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • primary alcohol
  • 1,2-diol
  • enoate ester
  • alcohol
  • organosulfonic acid ester
  • methanesulfonate
  • oxacycle
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound