Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:00 UTC
Update Date2025-03-21 18:05:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00057426
Frequency55.2
Structure
Chemical FormulaC3H6N2
Molecular Mass70.0531
SMILESCNCC#N
InChI KeyPVVRRUUMHFWFQV-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