Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:53:16 UTC
Update Date2025-03-24 14:05:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00754440
Frequency2.0
Structure
Chemical FormulaC4H7NS
Molecular Mass101.0299
SMILESCCCSC#N
InChI KeyVDQRHYCVPYJPHU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocyanates
Subclass thiocyanates
Direct Parent thiocyanates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • cyanide salts
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cyanide salt
  • thiocyanate