作为抗真菌剂的替代性醇衍生物:设计,合成,体外和体内评估
Ashish Lamsal1,2,3, Ashok Maurya1, Shankar Thapa1,4
1Department of Pharmacy, Universal College of Medical Science, Bhairahawa, Nepal.
The Journal of antibiotics
|December 21, 2025
概括
合成和测试Indole衍生物的抗真菌活性. 化合物A1和A2对Candida albicans和Aspergillus niger表现出强烈的疗效,作为有前途的抗真菌导体.
科学领域:
- 药用化学 医学化学
- 有机合成 有机合成
- 计算化学计算化学
背景情况:
- 印衍生物表现出广泛的生物活性.
- 抗真菌剂对于治疗由菌引起的感染至关重要,如Candida albicans和Aspergillus niger.
研究的目的:
- 为了合成新型的醇衍生物.
- 为了评估合成化合物的抗真菌活性.
- 通过分子对接来研究它们的作用机制.
主要方法:
- 费舍尔醇合成和乌尔曼凝结用于化合物合成.
- 使用点,UV-Vis,TLC,FTIR和NMR进行表征.
- 根据抑制区和最小抑制度评估的抗真菌活性.
- 对抗兰醇14α-脱甲基酶的分子对接 (PDBID: 5TZ1).
主要成果:
- 合成的母分子2-甲基-1H-醇 (B) 和衍生物A1,A2和A3.
- 化合物A1和A2表现出显著的抗真菌活性.
- 分子对接显示衍生物强烈与兰醇14α-脱甲基酶结合,其中A2表现出最高亲和力 (-8.1 kcal/mol).
结论:
- 印醇衍生物A1和A2是强大的抗真菌剂.
- 与兰醇14α-脱甲基酶的强烈分子相互作用表明一种可行的作用机制.
- 这些化合物代表了开发新抗真菌疗法的有希望的线索.
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