Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:24:31 UTC
Update Date2025-03-25 01:02:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02257355
Frequency0.5
Structure
Chemical FormulaC8H12N2
Molecular Mass136.1
SMILESCN1CCc2ccc([nH]2)C1
InChI KeyHDIBZQMGDQCWOF-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
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • pyrroles
  • trialkylamines
  • Substituents
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • aralkylamine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound