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  3. HIT214323294
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HIT214323294
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HIT214323294
  • HIT ID:HIT214323294
  • Cas No:2289585-58-4
  • 常用名:anti-TNBC agent-1
  • IUPAC:[(1S,2R,4R,7E,11S)-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.0^{2,4}]tetradec-7-en-8-yl]methyl (2E)-3-(2,6-dimethoxyphenyl)prop-2-enoate
    IUPAC:[(1S,2R,4R,7E,11S)-4-methyl-12-methylidene-13-oxo-3,14-dioxatricyclo[9.3.0.0^{2,4}]tetradec-7-en-8-yl]methyl (2E)-3-(2,6-dimethoxyphenyl)prop-2-enoate
  • InChI key:YVBBTBMJVZGTJA-PRIVVCGTSA-N
  • 分子式:C26H30O7
  • 分子量:454.519
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:[H][C@]12O[C@]1(C)CC\C=C(COC(=O)\C=C\c1c(OC)cccc1OC)/CC[C@@]1([H])C(=C)C(=O)O[C@]21[H] |t:8|
    SMILES:[H][C@]12O[C@]1(C)CC\C=C(COC(=O)\C=C\c1c(OC)cccc1OC)/CC[C@@]1([H])C(=C)C(=O)O[C@]21[H] |t:8|
  • anti-TNBC agent-1 is a highly effective compound specifically designed to target and combat triple-negative breast cancer (TNBC). It demonstrates remarkable potency against various breast cancer cell types, with IC50 values spanning from 0.20 μM to 0.27 μM. The mechanism of action of anti-TNBC agent-1 involves inducing apoptosis in SUM-159 cells through the mitochondria pathway, as well as causing G1 phase arrest in these cells.
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  • 供应商
    TargetMolSC
    规格
    货期
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    -
    ¥ 10,600.00
    1

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