Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:09 UTC
Update Date2025-03-25 00:46:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153870
Frequency0.5
Structure
Chemical FormulaC4H9NOS3
Molecular Mass182.9846
SMILESCS(=O)CCSC(N)=S
InChI KeyFKZGEEVYHGFYLV-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
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • organosulfur compound
  • dithiocarbamic acid ester
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound