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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:51:03 UTC
Update Date2025-03-24 20:55:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01611841
Frequency0.8
Structure
Chemical FormulaC7H14N+
Molecular Mass112.1121
SMILESC=C[N+]1(C)CCCC1
InChI KeyCVLQCVLNQNESQF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amines
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • quaternary ammonium salts
    • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • quaternary ammonium salt
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine