Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:39:59 UTC
Update Date2025-03-21 18:48:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00157253
Frequency15.3
Structure
Chemical FormulaC4H11NOS
Molecular Mass121.0561
SMILESOCCNCCS
InChI KeyUMDJVIOHWNPLHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent alkanolamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alkylthiols
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organosulfur compound
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound
  • alkanolamine