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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:54 UTC
Update Date2025-03-25 00:51:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189698
Frequency0.5
Structure
Chemical FormulaC8H16N2
Molecular Mass140.1313
SMILESCC(C)NC1=NCCCC1
InChI KeyQLBVATPUZYSHJL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent tetrahydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amidines
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • tetrahydropyridine
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam