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HIT212665964
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HIT212665964
  • HIT ID:HIT212665964
  • Cas No:139163-15-8
  • 常用名:Uralenol
  • 别名:乌拉尔醇
  • IUPAC:2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-4H-chromen-4-one
    IUPAC:2-[3,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-4H-chromen-4-one
  • InChI key:WOMWVGHYSNATOB-UHFFFAOYSA-N
  • 分子式:C20H18O7
  • 分子量:370.357
  • 氢键供体数 (HBD):5
  • 氢键受体数 (HBA):7
  • LogP:3.8848665
  • SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#8]
    SMILES:[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#8]
  • Uralenol significantly shows the inhibitory activities against the PTP1B enzyme; it also shows inhibitory activities on mushroom tyrosinase using l-tyrosine as substrate( IC50 =49.5 μM). Uralenol shows potent anti-proliferation effects on ER-positive breast cancer MCF-7 cells in vitro.
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