Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:58 UTC
Update Date2025-03-25 00:48:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169215
Frequency0.5
Structure
Chemical FormulaC8H17NS3
Molecular Mass223.0523
SMILESCCCNC(=S)SCCCSC
InChI KeyJJTMLUJAFMAKTR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classdithiocarbamic acids and derivatives
Subclass dithiocarbamic acid esters
Direct Parent dithiocarbamic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • dithiocarbamic acid ester
  • aliphatic acyclic compound
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organosulfur compound