Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:37:36 UTC
Update Date2025-03-25 01:07:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02287270
Frequency0.5
Structure
Chemical FormulaC6H12N2
Molecular Mass112.1
SMILESCNC(C#N)C(C)C
InChI KeyLHZPNEANLZZZHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic cyanides
Direct Parent nitriles
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • nitrile
  • organopnictogen compound
  • hydrocarbon derivative
  • secondary amine
  • carbonitrile
  • amine