Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:01:19 UTC
Update Date2025-03-24 21:53:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01922511
Frequency0.6
Structure
Chemical FormulaC8H13N
Molecular Mass123.1048
SMILESCN1C=CC2CCCC21
InChI KeyCUJXWBQBEQOPTA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • enamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • pyrroline
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • enamine