Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:48:58 UTC
Update Date2025-03-21 18:02:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00036055
Frequency98.3
Structure
Chemical FormulaC6H16NO2S+
Molecular Mass166.0896
SMILESC[N+](C)(C)CCS(C)(=O)=O
InChI KeyMJTGXYJMJNBQMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfonyls
Subclass sulfones
Direct Parent sulfones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine
  • sulfone