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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:12 UTC
Update Date2025-03-25 00:57:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222644
Frequency0.5
Structure
Chemical FormulaC7H12O9S
Molecular Mass272.0202
SMILESO=S(=O)(O)OCC1OC2OC(C1O)C(O)C2O
InChI KeyYAERAYMTZRDLNQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • acetals
  • alkyl sulfates
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • oxacyclic compounds
  • secondary alcohols
  • sulfuric acid monoesters
  • tetrahydrofurans
    • Substituents
  • alcohol
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • tetrahydrofuran
  • monosaccharide
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • acetal
  • alkyl sulfate
  • secondary alcohol
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • meta-dioxane
  • organooxygen compound