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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:16:44 UTC
Update Date2025-03-24 16:45:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00954591
Frequency1.5
Structure
Chemical FormulaC7H11N3
Molecular Mass137.0953
SMILESc1cn(C2CCNC2)cn1
InChI KeyWHQNOBWFVDSYOK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent n-substituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organopnictogen compounds
  • pyrrolidines
    • Substituents
  • secondary aliphatic amine
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • secondary amine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • n-substituted imidazole