Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:29 UTC
Update Date2025-03-25 00:55:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02214054
Frequency0.5
Structure
Chemical FormulaC8H17NOS
Molecular Mass175.1031
SMILESCCCCCCCOC(N)=S
InChI KeyPDXICZAHIMJHPC-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
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • thiocarbamic acid ester
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound