Hmdb loader

Showing information for DMID02411887

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:31:20 UTC
Update Date2025-03-25 01:27:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02411887
Frequency0.5
Structure
Chemical FormulaC6H11NOS
Molecular Mass145.0561
SMILESCC(C)(O)CCN=C=S
InChI KeyRALGEIRWRHGZHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • isothiocyanates
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • isothiocyanate
  • organic 1,3-dipolar compound
  • organosulfur compound
  • propargyl-type 1,3-dipolar organic compound
  • tertiary alcohol
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound