Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:46 UTC
Update Date2025-03-21 18:33:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00097481
Frequency28.3
Structure
Chemical FormulaC7H8FN
Molecular Mass125.0641
SMILESNCc1ccc(F)cc1
InChI KeyIIFVWLUQBAIPMJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aryl fluorides
  • hydrocarbon derivatives
  • monoalkylamines
  • organofluorides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aryl fluoride
  • organofluoride
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound