Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:04 UTC
Update Date2025-03-21 18:01:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00033869
Frequency113.4
Structure
Chemical FormulaC4H12O6P2S
Molecular Mass249.983
SMILESCCOP(=O)(O)OP(O)(=S)OCC
InChI KeyWRGHXYKQIDXCGF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic phosphoric acids and derivatives
Subclass phosphate esters
Direct Parent monoalkyl phosphates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • thiophosphoric acid esters
  • Substituents
  • organic thiophosphoric acid or derivatives
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • monoalkyl phosphate
  • thiophosphoric acid ester
  • hydrocarbon derivative
  • organooxygen compound