Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:50 UTC
Update Date2025-03-25 00:56:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217135
Frequency0.5
Structure
Chemical FormulaC15H19N
Molecular Mass213.1518
SMILESCN1CCC2CC2(C=Cc2ccccc2)C1
InChI KeyKYFWMBGYBWDXSP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepanes
Subclass azepanes
Direct Parent azepanes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organopnictogen compounds
  • piperidines
  • trialkylamines
  • Substituents
  • monocyclic benzene moiety
  • azacycle
  • tertiary aliphatic amine
  • azepane
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • piperidine
  • amine
  • tertiary amine