Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:51:22 UTC
Update Date2025-03-21 18:03:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00041765
Frequency93.8
Structure
Chemical FormulaC4H12NO2PS
Molecular Mass169.0326
SMILESCCOP(N)(=S)OCC
InChI KeyLAGRCNJEUAJJQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic thiophosphoric acids and derivatives
Subclass thiophosphoric acid esters
Direct Parent thiophosphoric acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic nitrogen compounds
  • organooxygen compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • thiophosphoric acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound