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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:22 UTC
Update Date2025-03-25 00:46:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156638
Frequency0.5
Structure
Chemical FormulaC5H8O6S
Molecular Mass196.0042
SMILESO=C1CC(S(=O)(=O)O)C(CO)O1
InChI KeyITGCDRUTNXFJIH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfonic acids
  • oxacyclic compounds
  • primary alcohols
  • sulfonyls
  • tetrahydrofurans
    • Substituents
  • alcohol
  • organosulfonic acid or derivatives
  • carbonyl group
  • tetrahydrofuran
  • organosulfonic acid
  • organosulfur compound
  • carboxylic acid derivative
  • gamma butyrolactone
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • organic sulfonic acid or derivatives
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound