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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:35:49 UTC
Update Date2025-03-21 22:51:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00570353
Frequency2.9
Structure
Chemical FormulaC4H9N3
Molecular Mass99.0796
SMILESNCC1=NCCN1
InChI KeyLDRSQURIJAHKPI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidolactams
Subclass imidolactams
Direct Parent imidolactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidazolines
  • monoalkylamines
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • 2-imidazoline
  • imidazoline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • imidolactam