Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:36 UTC
Update Date2025-03-25 00:46:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154934
Frequency0.5
Structure
Chemical FormulaC12H10FN
Molecular Mass187.0797
SMILESCc1ccc(-c2cccnc2)cc1F
InChI KeyFSMCAZITLIMOJR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl fluorides
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • toluenes
  • Substituents
  • aryl fluoride
  • aromatic heteromonocyclic compound
  • azacycle
  • organofluoride
  • heteroaromatic compound
  • methylpyridine
  • organohalogen compound
  • aryl halide
  • fluorobenzene
  • pyridine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • toluene
  • organoheterocyclic compound