Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:38 UTC
Update Date2025-03-25 00:57:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02228006
Frequency0.5
Structure
Chemical FormulaC12H13N
Molecular Mass171.1048
SMILESC1=CN2CCCC2c2ccccc21
InChI KeyAIPWWWGRHJSURV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • enamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrrolidines
  • trialkylamines
  • Substituents
  • azacycle
  • tertiary aliphatic amine
  • aralkylamine
  • aromatic heteropolycyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • pyrrolidine
  • tertiary amine
  • organoheterocyclic compound
  • enamine