Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:24:48 UTC
Update Date2025-03-21 18:38:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00121884
Frequency21.2
Structure
Chemical FormulaC11H12N2
Molecular Mass172.1
SMILESc1ccc(CCn2ccnc2)cc1
InChI KeySSENHTOBLYRWKU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent n-substituted imidazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • n-substituted imidazole