Hmdb loader

Showing information for DMID02151706

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:15 UTC
Update Date2025-03-25 00:45:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151706
Frequency0.5
Structure
Chemical FormulaC18H15ClN2
Molecular Mass294.0924
SMILESClc1ccc2c(c1)CCc1cccnc1C2=C1CCC=N1
InChI KeyCELYDBSFCLNBDH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzocycloheptapyridines
Subclass benzocycloheptapyridines
Direct Parent benzocycloheptapyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • aryl chlorides
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • organochlorides
  • organopnictogen compounds
  • polyhalopyridines
  • propargyl-type 1,3-dipolar organic compounds
  • pyridines and derivatives
  • pyrrolines
    • Substituents
  • aryl chloride
  • azacycle
  • imine
  • polyhalopyridine
  • organochloride
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • organohalogen compound
  • aryl halide
  • propargyl-type 1,3-dipolar organic compound
  • pyridine
  • pyrroline
  • aromatic heteropolycyclic compound
  • benzocycloheptapyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound