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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:15 UTC
Update Date2025-03-25 00:57:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222769
Frequency0.5
Structure
Chemical FormulaC7H15O12PS
Molecular Mass354.0022
SMILESO=P(O)(O)OCC1C(O)C(O)C(O)C(O)C1OS(=O)(=O)O
InChI KeyBPPDJRADPNNWFG-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
  • alkyl sulfates
  • cyclitols and derivatives
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • sulfuric acid monoesters
  • Substituents
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • cyclohexanol
  • cyclitol or derivatives
  • cyclic alcohol
  • organic oxide
  • phosphoric acid ester
  • monoalkyl phosphate
  • alkyl sulfate
  • aliphatic homomonocyclic compound
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organic phosphoric acid derivative
  • alkyl phosphate