Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:43:23 UTC
Update Date2025-03-24 21:19:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01738394
Frequency0.7
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCCC[SH]=CC(=O)O
InChI KeyWXADUPJNMXCUNS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids
Direct Parent carboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • thioaldehydes
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • thioaldehyde
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound