药材来源(中文) | 紫花高乌头 |
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化学成分名称(英文) | 4'-Demethyldeoxypodophyllotoxin |
CAS号 | 3590-93-0 |
分子式 | C21H20O7 |
分子量 | 384.379 |
靶点 | Steryl-sulfatase precursor |
生物活性 | P388; KB, ED50=0.0012μg/mL; KB, IC50=17.7ng/mL (control: vincaleukoblastinum, IC50=9.7ng/mL); LNCaP, IC50=10.0ng/mL (control: vincaleukoblastinum, IC50=10.5ng/mL); Co12, IC50=23.1ng/mL (control: vincaleukoblastinum, IC50=8.1ng/Ml); P388; PC3, IC50=10.6±1.5μM(72h), inhibition=67.1±3.4(%, 20μM, 72h); Bcap-37, IC50=13.2±0.5μM(72h), inhibition=56.6±12.3(%, 20μM, 72h); BGC823, IC50=11.5±0.6μM(72h), inhibition=60.7±9.8(%, 20μM, 72h); NIT3T3, inhibition=59.8±3.5(%, 20μM, 72h); adriamycin(control, PC3, inhibition=93.2±1.6(%, 20μM, 72h); Bcap-37, inhibition=90.6±1.2(%, 20μM, 72h); BGC823, inhibition=98.3±4.0(%, 20μM, 72h); NIT3T3, inhibition=97.5±1.7(%, 20μM, 72h)); LNCaP, IC50=0.15μM(48h); PC3, IC50=0.14μM(48h) |
结构式 | |
SMILES分子结构 | COC1=CC(=CC(=C1O)OC)[COH]2[COOH]3[COOH](CC4=CC5=C(C=C24)OCO5)COC3=O |
AI活性预测 | 查看 |
扩展信息