Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:10 UTC
Update Date2025-03-25 00:57:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222558
Frequency0.5
Structure
Chemical FormulaC4H4O6S
Molecular Mass179.9729
SMILESO=C1OCC2OS(=O)(=O)OC12
InChI KeyYNGADPBSQNRHTM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfuric acids and derivatives
Subclass sulfuric acid esters
Direct Parent sulfuric acid diesters
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl sulfates
  • carbonyl compounds
  • carboxylic acid esters
  • dioxathiolanes
  • gamma butyrolactones
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • dioxathiolane
  • carbonyl group
  • tetrahydrofuran
  • carboxylic acid derivative
  • gamma butyrolactone
  • lactone
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfuric acid diester
  • carboxylic acid ester
  • alkyl sulfate
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound