Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:42:17 UTC
Update Date2025-03-21 17:59:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00020405
Frequency198.5
Structure
Chemical FormulaC4H6OS
Molecular Mass102.0139
SMILESCSC=CC=O
InChI KeyGMTLWWYVRPTAIY-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
  • organic oxides
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • vinylogous thioester
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • sulfenyl compound
  • aldehyde
  • hydrocarbon derivative
  • organosulfur compound
  • organooxygen compound