Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:30:19 UTC
Update Date2025-03-24 22:14:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01130637
Frequency1.2
Structure
Chemical FormulaC4H6O2S
Molecular Mass118.0088
SMILESCC(=O)OC(C)=S
InChI KeyWSEXFCMXTKMFOA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classthiocarboxylic acids and derivatives
Subclass thiocarboxylic acids and derivatives
Direct Parent thiocarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • thiocarbonyl compounds
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thiocarbonyl group
  • hydrocarbon derivative
  • organosulfur compound
  • carboxylic acid derivative
  • organooxygen compound