Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:33 UTC
Update Date2025-03-21 18:39:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123616
Frequency20.8
Structure
Chemical FormulaC8H20NOS+
Molecular Mass178.126
SMILESCS(=O)CCCC[N+](C)(C)C
InChI KeyDYIOUIKBZHIIOY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine