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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:21 UTC
Update Date2025-03-25 00:47:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02163227
Frequency0.5
Structure
Chemical FormulaC7H12O9S
Molecular Mass272.0202
SMILESO=C(O)C1C(O)C(O)C(O)C(O)C1OS(=O)O
InChI KeyDJZDMTAOGFCJKT-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
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
    • Substituents
  • carbonyl group
  • carboxylic acid
  • cyclohexanol
  • cyclitol or derivatives
  • hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative