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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:58 UTC
Update Date2025-03-21 18:02:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00040819
Frequency84.5
Structure
Chemical FormulaC12H20O8S
Molecular Mass324.0879
SMILESCC1(C)OC2COC3(CO[SH](=O)=O)OC(C)(C)OC3C2O1
InChI KeyWULQQYAWDQZTOA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxolopyrans
Subclass dioxolopyrans
Direct Parent dioxolopyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • ketals
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • sulfonic acid esters
    • Substituents
  • meta-dioxolane
  • monosaccharide
  • aliphatic heteropolycyclic compound
  • sulfonic acid ester
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • acetal
  • ketal
  • hydrocarbon derivative
  • oxane
  • dioxolopyran
  • organooxygen compound