Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:35:36 UTC
Update Date2025-03-24 21:15:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01719509
Frequency0.7
Structure
Chemical FormulaC4H11NOS
Molecular Mass121.0561
SMILESCSCC(C)(N)O
InChI KeyJDCWEJQKPAGAEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent hemiaminals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • hemiaminal
  • organic oxygen compound
  • thioether
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organooxygen compound