Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:45:44 UTC
Update Date2025-03-24 17:57:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01023894
Frequency1.4
Structure
Chemical FormulaC5H10OS
Molecular Mass118.0452
SMILESC=CC(C)=[SH](C)=O
InChI KeyKCDLBCWZSYTUJD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioketones
Direct Parent thioketone s-oxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • s-alkylsulfenates
  • Substituents
  • aliphatic acyclic compound
  • s-alkylsulfenate
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol
  • thioketone-s-oxide