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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:20 UTC
Update Date2025-03-25 01:01:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252458
Frequency0.5
Structure
Chemical FormulaC4H11N3O
Molecular Mass117.0902
SMILESNCCCCNN=O
InChI KeyFWVMVWMTKANPCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic nitroso compounds
Direct Parent organic n-nitroso compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • organic n-nitroso compound
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine