Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:50:45 UTC
Update Date2025-03-24 22:23:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01179800
Frequency1.1
Structure
Chemical FormulaC6H13NS
Molecular Mass131.0769
SMILESCSC1CCN(C)C1
InChI KeyKGIUXXPEKNKXNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • organopnictogen compounds
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • sulfenyl compound
  • azacycle
  • n-alkylpyrrolidine
  • dialkylthioether
  • tertiary aliphatic amine
  • organosulfur compound
  • thioether
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine