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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:26 UTC
Update Date2025-03-25 00:49:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177247
Frequency0.5
Structure
Chemical FormulaC16H15FO2
Molecular Mass258.1056
SMILESFc1ccc(C2(c3ccccc3)COCCO2)cc1
InChI KeySTAXSXMLSFCECR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylmethanes
Direct Parent diphenylmethanes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,4-dioxanes
  • aryl fluorides
  • dialkyl ethers
  • fluorobenzenes
  • hydrocarbon derivatives
  • organofluorides
  • oxacyclic compounds
    • Substituents
  • aryl fluoride
  • diphenylmethane
  • ether
  • aromatic heteromonocyclic compound
  • organofluoride
  • organohalogen compound
  • dialkyl ether
  • aryl halide
  • oxacycle
  • fluorobenzene
  • organic oxygen compound
  • para-dioxane
  • hydrocarbon derivative
  • halobenzene
  • organoheterocyclic compound
  • organooxygen compound