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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:23:13 UTC
Update Date2025-03-25 01:02:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02254400
Frequency0.5
Structure
Chemical FormulaC27H24FNO3
Molecular Mass429.174
SMILESCC(C)(C)c1oc(-c2ccc(F)cc2)c(-c2ccccc2)c1C(O)=Nc1ccccc1O
InChI KeyFODAGYSGEDMMII-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass halobenzenes
Direct Parent fluorobenzenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aryl fluorides
  • carboximidic acids
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organofluorides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aryl fluoride
  • furan
  • carboximidic acid
  • aromatic heteromonocyclic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • propargyl-type 1,3-dipolar organic compound
  • fluorobenzene
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • organofluoride
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • aryl halide
  • oxacycle
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound