生物导向合成和分子对接研究1,2,4-三醇基衍生物作为潜在的抗癌剂对HepG2细胞系的抗癌作用

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Updated: Jul 28, 2025

Functionalized Spirocyclic Heterocycle Synthesis and Cytotoxicity Assay

Functionalized Spirocyclic Heterocycle Synthesis and Cytotoxicity Assay

Published on: February 9, 2021

Naheed Akhter¹, Sidra Batool², Samreen Gul Khan²

¹Department of Biochemistry, Faculty of Life Science, Government College University Faisalabad, Faisalabad 38000, Pakistan.

Pharmaceuticals (Basel, Switzerland)

|June 1, 2023

概括

新的基于三醇的乙胺衍生物被合成并测试了抗肝癌活性. 化合物7f对肝细胞癌细胞表现出显著的抗增殖作用,表明其作为治疗剂的潜力.

科学领域:

药用化学医学化学
有机合成有机合成
药理学药理学是指药理学的学科.

背景情况:

基于triazole的乙胺是药物发现中的关键支架.
肝细胞癌 (HCC) 仍然是一个重大的全球健康挑战,需要新的治疗策略.

研究的目的:

为了合成1,2,4-triazole和乙胺的新型结构混合物.
为了评估这些衍生物对HepG2细胞系的抗肝癌活性.

主要方法:

化学修饰的2 - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - - -
通过三醇合合成目标化合物7a-f.
物理化学和光谱学表征 (HRMS,FTIR,NMR) 进行.
在体外抗繁殖试验和分子对接研究.

主要成果:

合成的7a-f化合物产量很好 (70-76%).
化合物7f对HepG2细胞具有强烈的抗增殖活性,IC50为16.782μg/mL,毒性低.
分子对接揭示了化合物7f与c-kit氨酸激酶和蛋白质激酶B的强大的结合亲和关系.

结论:

化合物7f是肝细胞癌治疗的有前途的药剂.
合成的三醇-合乙胺衍生物有可能在瘤学中进一步开发药物.

关键词:

一,二,四-三醇的使用.2-(4-异布基) 酸是酸的一种.乙胺酸的使用方法这是一种抗癌药物.肝细胞癌是肝细胞癌.分子对接的分子对接.

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