Hmdb loader
Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:37:46 UTC
Update Date2025-03-21 17:57:48 UTC
HMDB IDHMDB0254585
Metabolite Identification
DeepMet IDDMID00010278
NameMethyl diethyldithiocarbamate
Frequency461.1
Structure
Chemical FormulaC6H13NS2
Molecular Mass163.0489
SMILESCCN(CC)C(=S)SC
InChI KeyJYRXPFCUABYLPD-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
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • dithiocarbamic acid ester
  • aliphatic acyclic compound
  • sulfenyl compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organosulfur compound