Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:14:25 UTC
Update Date2025-03-21 20:50:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00376815
Frequency4.9
Structure
Chemical FormulaC7H17N2+
Molecular Mass129.1386
SMILESC[N+]1(C)CCCC1CN
InChI KeyKADLCISMLGYGHC-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
  • monoalkylamines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • tetraalkylammonium salt
  • azacycle
  • n-alkylpyrrolidine
  • quaternary ammonium salt
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine