Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:46:09 UTC
Update Date2025-03-24 21:46:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01886858
Frequency0.6
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCC(C)=[SH]CC(=O)O
InChI KeyBHCOVUFNEQVNHD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioketones
Direct Parent thioketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioketone
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound