Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:33 UTC
Update Date2025-03-25 00:54:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204799
Frequency0.5
Structure
Chemical FormulaC4H8O5S
Molecular Mass168.0092
SMILESO=S1(=O)OCCC(CO)O1
InChI KeyJVMOYEQRSUIASW-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 heteromonocyclic compounds
Alternative Parents
  • alkyl sulfates
  • dioxathiolanes
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • primary alcohols
  • Substituents
  • alcohol
  • dioxathiolane
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • sulfuric acid diester
  • alkyl sulfate
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound