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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:20:11 UTC
Update Date2025-03-24 20:42:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01538741
Frequency0.8
Structure
Chemical FormulaC9H19N
Molecular Mass141.1518
SMILESCN1C(C)(C)CCC1(C)C
InChI KeyKGIFNEFQLJMDQJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass n-alkylpyrrolidines
Direct Parent n-alkylpyrrolidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine