Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:31:07 UTC
Update Date2025-03-25 01:27:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02411393
Frequency0.5
Structure
Chemical FormulaC6H12N2
Molecular Mass112.1
SMILESNCCN1C=CCC1
InChI KeyABOAZLNMRQLBNH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • enamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • tertiary aliphatic amine
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • amine
  • tertiary amine
  • enamine