Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:17:03 UTC
Update Date2025-03-21 23:12:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00667375
Frequency2.4
Structure
Chemical FormulaC7H13N
Molecular Mass111.1048
SMILESCN1CC2CCC2C1
InChI KeyRGOQOMIRSBZPMD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • azacycle
  • n-alkylpyrrolidine
  • tertiary aliphatic amine
  • aliphatic heteropolycyclic compound
  • azepane
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine