Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:08 UTC
Update Date2025-03-25 00:54:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02208415
Frequency0.5
Structure
Chemical FormulaC10H21NO2S2
Molecular Mass251.1014
SMILESCC(C)COC(=S)NCCCCS(C)=O
InChI KeyHRAIGDMEKSYMLF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thiocarbamic acid derivatives
Direct Parent thiocarbamic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • thiocarbamic acid ester
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound