Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:06:21 UTC
Update Date2025-03-21 19:03:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00219071
Frequency9.9
Structure
Chemical FormulaC4H8O2S
Molecular Mass120.0245
SMILESCOC(=O)C(C)S
InChI KeySNWKNPMDQONHKK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent methyl esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organosulfur compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound