Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:34:55 UTC
Update Date2025-03-21 19:58:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00285171
Frequency11.9
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESCCOC(S)=NC
InChI KeyPTQVKYJDNZLWCR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic 1,3-dipolar compounds
Classpropargyl-type 1,3-dipolar organic compounds
Subclass propargyl-type 1,3-dipolar organic compounds
Direct Parent propargyl-type 1,3-dipolar organic compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • imine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organosulfur compound
  • organooxygen compound
  • propargyl-type 1,3-dipolar organic compound