Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:38 UTC
Update Date2025-03-25 00:55:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214402
Frequency0.5
Structure
Chemical FormulaC10H15O3PS
Molecular Mass246.048
SMILESCCOP(O)(=S)Oc1ccc(C)cc1C
InChI KeyBTJILKBZKSTGDC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic thiophosphoric acids and derivatives
Subclass thiophosphoric acid esters
Direct Parent phenyl thiophosphates
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organooxygen compounds
  • phenoxy compounds
  • thiophosphate diesters
  • m-xylenes
  • Substituents
  • monocyclic benzene moiety
  • m-xylene
  • phenyl thiophosphate
  • thiophosphate diester
  • aromatic homomonocyclic compound
  • xylene
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound