Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:11 UTC
Update Date2025-03-25 00:56:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220314
Frequency0.5
Structure
Chemical FormulaC4H8O2S2
Molecular Mass151.9966
SMILESCS[SH]=C(C)C(=O)O
InChI KeyAGUWFYMKTUHFKT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioketones
Direct Parent thioketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioketone
  • hydrocarbon derivative
  • organooxygen compound