Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:18 UTC
Update Date2025-03-21 18:07:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00067642
Frequency44.9
Structure
Chemical FormulaC4H8O4S
Molecular Mass152.0143
SMILESO=C(O)C(O)(CO)CS
InChI KeyFJRRLCOVTJFSMO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • alkylthiols
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • organosulfur compound
  • carboxylic acid derivative
  • beta-hydroxy acid
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound
  • 1,2-diol