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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:02:04 UTC
Update Date2025-03-21 18:07:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00067068
Frequency45.4
Structure
Chemical FormulaC4H10O2S
Molecular Mass122.0402
SMILESCC(O)CS(C)=O
InChI KeyCQZCYFMCMRDKNN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • sulfinyl compounds
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound