Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:03:02 UTC
Update Date2025-03-24 21:00:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01641031
Frequency0.8
Structure
Chemical FormulaC8H13N
Molecular Mass123.1048
SMILESC1=C2CCCN2CCC1
InChI KeyOSFPGTDISCSIFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • enamines
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • tetrahydropyridine
  • aliphatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine
  • enamine