Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:57:24 UTC
Update Date2025-03-21 23:01:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00621261
Frequency2.6
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESCN(C)CC(O)=S
InChI KeySDGFYICLOZPUFV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent trialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbodithioic acids
  • carbonyl compounds
  • carbothioic o-acids
  • hydrocarbon derivatives
  • organopnictogen compounds
  • thiocarbonyl compounds
  • thiocarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • tertiary aliphatic amine
  • thiocarbonyl group
  • carbodithioic acid
  • organosulfur compound
  • organic oxygen compound
  • carbothioic o-acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound