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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:33 UTC
Update Date2025-03-25 00:52:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02191103
Frequency0.5
Structure
Chemical FormulaC18H17FO
Molecular Mass268.1263
SMILESC=CC1(c2ccc(F)cc2)Cc2ccc(C)cc2CO1
InChI KeyOYUVCXPPSIFPPU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 2-benzopyrans
Direct Parent 2-benzopyrans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl fluorides
  • dialkyl ethers
  • fluorobenzenes
  • hydrocarbon derivatives
  • organofluorides
  • oxacyclic compounds
    • Substituents
  • aryl fluoride
  • monocyclic benzene moiety
  • ether
  • organofluoride
  • organohalogen compound
  • dialkyl ether
  • aryl halide
  • oxacycle
  • fluorobenzene
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • 2-benzopyran
  • hydrocarbon derivative
  • benzenoid
  • halobenzene
  • organooxygen compound