Hmdb loader

Showing information for DMID00732666

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:44:12 UTC
Update Date2025-03-24 14:01:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00732666
Frequency2.1
Structure
Chemical FormulaC4H7NO
Molecular Mass85.0528
SMILESCC(C)N=C=O
InChI KeyGSLTVFIVJMCNBH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass isocyanates
Direct Parent isocyanates
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • isocyanate
  • organopnictogen compound
  • hydrocarbon derivative
  • organic 1,3-dipolar compound
  • organooxygen compound
  • propargyl-type 1,3-dipolar organic compound