Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:30:51 UTC
Update Date2025-03-21 20:57:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00416156
Frequency4.3
Structure
Chemical FormulaC5H9NOS
Molecular Mass131.0405
SMILESC=CCNC(=S)OC
InChI KeyKFQCYQPZTRDLBX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thiocarbamic acid derivatives
Direct Parent thiocarbamic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • thiocarbamic acid ester
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound