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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:27 UTC
Update Date2025-03-21 18:34:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101630
Frequency26.8
Structure
Chemical FormulaC8H10FNO
Molecular Mass155.0746
SMILESNCCc1ccc(O)c(F)c1
InChI KeyMBQWGRWJFUWYAA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass halophenols
Direct Parent halophenols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl fluorides
  • fluorobenzenes
  • hydrocarbon derivatives
  • monoalkylamines
  • o-fluorophenols
  • organofluorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
    • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • organofluoride
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • 2-fluorophenol
  • aryl halide
  • aromatic homomonocyclic compound
  • 2-halophenol
  • fluorobenzene
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • halobenzene
  • organooxygen compound