Hmdb loader

Showing information for DMID00195364

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:56:10 UTC
Update Date2025-03-21 18:53:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00195364
Frequency11.5
Structure
Chemical FormulaC4H7NOS
Molecular Mass117.0248
SMILESCOCCN=C=S
InChI KeyHTSAVXAFEVUJQE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classisothiocyanates
Subclass isothiocyanates
Direct Parent isothiocyanates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • isothiocyanate
  • ether
  • organic 1,3-dipolar compound
  • dialkyl ether
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound