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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:41 UTC
Update Date2025-03-25 00:54:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205107
Frequency0.5
Structure
Chemical FormulaC6H12O13S2
Molecular Mass355.9719
SMILESO=S(=O)(O)OCC1OC(O)C(OOS(=O)(=O)O)C(O)C1O
InChI KeyBANOBOQXNNQOIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoanionic compounds
Subclass organic peroxomonosulfates
Direct Parent organic peroxomonosulfates
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • alkyl sulfates
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • sulfuric acid monoesters
    • Substituents
  • alcohol
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • monosaccharide
  • organic peroxomonosulfate
  • oxacycle
  • saccharide
  • organic oxide
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • sulfate-ester
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • sulfuric acid ester
  • organoheterocyclic compound
  • organooxygen compound
  • 1,2-diol