Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:42:15 UTC
Update Date2025-03-25 01:32:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02437444
Frequency0.5
Structure
Chemical FormulaC4H6O3S
Molecular Mass134.0038
SMILESO=C(O)C1(O)CSC1
InChI KeyFXXAFUAYFRUPGH-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 heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • tertiary alcohols
  • thietanes
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • dialkylthioether
  • alpha-hydroxy acid
  • thietane
  • carboxylic acid derivative
  • tertiary alcohol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound