Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:12:37 UTC
Update Date2025-03-24 14:13:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00800324
Frequency1.9
Structure
Chemical FormulaC4H6O3S
Molecular Mass134.0038
SMILESO=CCC(S)C(=O)O
InChI KeyGIXDDVADVZHECS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent thia fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • alpha-hydrogen aldehydes
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • aldehyde
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • thia fatty acid
  • organic oxygen compound
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound