Hmdb loader

Showing information for DMID02536461

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:24:45 UTC
Update Date2025-03-25 01:50:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02536461
Frequency0.5
Structure
Chemical FormulaC4H8NPS
Molecular Mass133.0115
SMILESCPCCN=C=S
InChI KeyCXYWJRICEOWHGT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classisothiocyanates
Subclass isothiocyanates
Direct Parent isothiocyanates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organophosphorus compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • isothiocyanate
  • organonitrogen compound
  • organopnictogen compound
  • organophosphorus compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • organic nitrogen compound
  • propargyl-type 1,3-dipolar organic compound