Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:19:51 UTC
Update Date2025-03-24 20:01:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01105486
Frequency1.2
Structure
Chemical FormulaC6H9NS
Molecular Mass127.0456
SMILESC1CC2CCSC2=N1
InChI KeyONKUHYGUNBRQAL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classimidothioesters
Subclass imidothiolactones
Direct Parent imidothiolactones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • thiolanes
  • Substituents
  • thiolane
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • pyrroline
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidothiolactone
  • organoheterocyclic compound