Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:37 UTC
Update Date2025-03-25 00:54:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204961
Frequency0.5
Structure
Chemical FormulaC4H7O8PS
Molecular Mass245.9599
SMILESO=P1(O)OCC2OS(=O)(=O)OCC2O1
InChI KeyBINUYOKLQFJGHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass sulfuric acid esters
Direct Parent sulfuric acid diesters
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl sulfates
  • dioxathiolanes
  • hydrocarbon derivatives
  • organic oxides
  • organic phosphoric acids and derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • Substituents
  • dioxathiolane
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • sulfuric acid diester
  • alkyl sulfate
  • hydrocarbon derivative
  • organic phosphoric acid derivative
  • organoheterocyclic compound
  • organooxygen compound