Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:09 UTC
Update Date2025-03-25 00:48:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169634
Frequency0.5
Structure
Chemical FormulaC8H13O5PS
Molecular Mass252.0221
SMILESCCOP(O)(=S)OCc1ccc(CO)o1
InChI KeyVNNJQVKARURKBT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic thiophosphoric acids and derivatives
Subclass thiophosphoric acid esters
Direct Parent thiophosphate diesters
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aromatic alcohol
  • alcohol
  • furan
  • aromatic heteromonocyclic compound
  • heteroaromatic compound
  • thiophosphate diester
  • oxacycle
  • organic oxygen compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound