Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:35:12 UTC
Update Date2025-03-21 17:56:54 UTC
HMDB IDHMDB0112254
Metabolite Identification
DeepMet IDDMID00004315
NameAllyl methyl sulfoxide
Frequency1304.0
Structure
Chemical FormulaC4H8OS
Molecular Mass104.0296
SMILESC=CCS(C)=O
InChI KeyJWWFEYMQBBFIRT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • hydrocarbon derivatives
  • organic oxides
  • sulfinyl compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • allyl sulfur compound
  • sulfoxide
  • hydrocarbon derivative