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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:48 UTC
Update Date2025-03-25 00:50:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02182643
Frequency0.5
Structure
Chemical FormulaC12H22O17S2
Molecular Mass502.0298
SMILESO=CC(O)C(O)C(OC1C(O)C(COS(=O)(=O)O)OC(OS(=O)(=O)O)C1O)C(O)CO
InChI KeyXLDBRVNBZSPWRV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acyl glycosides
Direct Parent fatty acyl glycosides of mono- and disaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl glycosides
  • alkyl sulfates
  • alpha-hydroxyaldehydes
  • beta-hydroxy aldehydes
  • dialkyl ethers
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
  • sulfuric acid monoesters
    • Substituents
  • fatty acyl glycoside of mono- or disaccharide
  • beta-hydroxy aldehyde
  • sulfuric acid monoester
  • carbonyl group
  • ether
  • monosaccharide
  • dialkyl ether
  • saccharide
  • organic oxide
  • alpha-hydroxyaldehyde
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • oxane
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • organic sulfuric acid or derivatives
  • aldehyde
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organooxygen compound
  • alkyl glycoside