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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:32:38 UTC
Update Date2025-03-25 00:19:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01282286
Frequency1.0
Structure
Chemical FormulaC24H42O36S5
Molecular Mass1066.0059
SMILESO=S(=O)(O)OCC1OC(OC2C(O)C(COS(=O)(=O)O)OC(OC3C(COS(=O)(=O)O)OC(OC4C(O)C(O)OC(COS(=O)(=O)O)C4O)OC3COS(=O)(=O)O)C2O)C(O)C(O)C1O
InChI KeyPGFKUEPOXKWWOJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorthocarboxylic acid derivatives
Subclass carboxylic acid orthoesters
Direct Parent carboxylic acid orthoesters
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • acetals
  • alkyl sulfates
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • ortho esters
  • oxacyclic compounds
  • oxanes
  • secondary alcohols
  • sulfuric acid monoesters
    • Substituents
  • alcohol
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • ortho ester
  • monosaccharide
  • carboxylic acid orthoester
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • acetal
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • sulfate-ester
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • sulfuric acid ester
  • meta-dioxane
  • organoheterocyclic compound
  • organooxygen compound