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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:46:16 UTC
Update Date2025-03-21 18:00:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00029595
Frequency126.2
Structure
Chemical FormulaC8H14O6S
Molecular Mass238.0511
SMILESO=C(CC1CCC(O)CC1)OS(=O)(=O)O
InChI KeyQESLFHJVGIZOGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclohexanols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • cyclic alcohols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfuric acid monoesters
    • Substituents
  • sulfuric acid monoester
  • carbonyl group
  • organic sulfuric acid or derivatives
  • cyclohexanol
  • cyclic alcohol
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • sulfuric acid ester