Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:05:55 UTC
Update Date2025-03-21 18:29:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00076337
Frequency38.6
Structure
Chemical FormulaC6H13O12PS
Molecular Mass339.9865
SMILESO=P(O)(O)OC1C(O)C(O)C(O)C(O)C1OS(=O)(=O)O
InChI KeyUIBJWUGGBROXIJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent inositol phosphates
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • alkyl sulfates
  • cyclohexanols
  • hydrocarbon derivatives
  • monoalkyl phosphates
  • organic oxides
  • sulfuric acid monoesters
  • Substituents
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • cyclohexanol
  • inositol phosphate
  • organic oxide
  • phosphoric acid ester
  • monoalkyl phosphate
  • alkyl sulfate
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organic phosphoric acid derivative
  • alkyl phosphate