Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:12 UTC
Update Date2025-03-25 00:56:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02220329
Frequency0.5
Structure
Chemical FormulaC5H10O3S2
Molecular Mass182.0071
SMILESCSSCC(C)(O)C(=O)O
InChI KeyXZMFMWIFBRJGLX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass alpha hydroxy acids and derivatives
Direct Parent alpha hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkyldisulfides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • alpha-hydroxy acid
  • organosulfur compound
  • carboxylic acid derivative
  • dialkyldisulfide
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organic disulfide
  • hydrocarbon derivative
  • organooxygen compound