Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:06:12 UTC
Update Date2025-03-24 20:10:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01361992
Frequency1.0
Structure
Chemical FormulaC6H11NOS
Molecular Mass145.0561
SMILESCC(C=O)=CSCCN
InChI KeyRIBNMRGRNVSEHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous thioesters
Subclass vinylogous thioesters
Direct Parent vinylogous thioesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • aldehydes
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • vinylogous thioester
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • aldehyde
  • organosulfur compound
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound