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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:35:12 UTC
Update Date2025-03-24 20:49:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01575266
Frequency0.8
Structure
Chemical FormulaC4H10O2S
Molecular Mass122.0402
SMILESCC(C)(C)[SH](=O)=O
InChI KeyJSWOQIVKZUWQHA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • s-alkylsulfenates
    • Substituents
  • aliphatic acyclic compound
  • s-alkylsulfenate
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol