Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:11:14 UTC
Update Date2025-03-21 19:06:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00230077
Frequency9.3
Structure
Chemical FormulaC5H8O2S
Molecular Mass132.0245
SMILESCC=C(SC)C(=O)O
InChI KeyOBTDRZKZDIAHEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent unsaturated fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • organosulfur compound
  • carboxylic acid derivative
  • unsaturated fatty acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • thioenolether
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound