Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:13:31 UTC
Update Date2025-03-21 18:33:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00094431
Frequency29.4
Structure
Chemical FormulaC6H16NO3PS
Molecular Mass213.0589
SMILESCCOP(=S)(OCC)OCCN
InChI KeyDTFFHPVQLNXESU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic thiophosphoric acids and derivatives
Subclass thiophosphoric acid esters
Direct Parent thiophosphate triesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • thiophosphate triester
  • organic nitrogen compound
  • organooxygen compound