Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:47:29 UTC
Update Date2025-03-24 20:28:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01459407
Frequency0.9
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESCCN(C)C(O)=S
InChI KeyPXRIUBJGUAIJCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classthiocarbamic acids
Subclass thiocarbamic acids
Direct Parent thiocarbamic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • thiocarbamic acid derivatives
  • Substituents
  • thiocarbamic acid derivative
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organosulfur compound
  • organooxygen compound
  • thiocarbamic acid