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Record Information
HMDB Statusdetected
Creation Date2024-02-21 11:12:16 UTC
Update Date2025-03-24 21:04:31 UTC
HMDB IDHMDB0255236
Metabolite Identification
DeepMet IDDMID01663348
NameN-Propyl-N-nitrosourea
Frequency0.7
Structure
Chemical FormulaC4H9N3O2
Molecular Mass131.0695
SMILESCCCN(N=O)C(=N)O
InChI KeyYGGSSUISOYLCBF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass ureas
Direct Parent nitrosoureas
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • nitrosamides
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • semicarbazides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic nitroso compound
  • nitrosamide
  • nitrosourea
  • organic n-nitroso compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • semicarbazide
  • organooxygen compound