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Phytochemical and antimicrobial properties of different plants and in silico investigation of their bioactive compounds in wound healing and rheumatism
Saudi Journal of Biological Sciences ( IF 4.4 ) Pub Date : 2024-01-28 , DOI: 10.1016/j.sjbs.2024.103942
Roheena Abdullah , Qamar Younas , Afshan Kaleem , Mehwish Iqtedar , Mahwish Aftab , Faiza Saleem

In the current study the assessment of the antimicrobial and phytochemical properties of Cassia fistula, Musa paradisiaca, Ficus religiosa and Murraya koenigii plants extracts was carried out. The antibacterial potential of these plants extracts was tested against S. aureus and E. coli. The Cassia fistula and Ficus religiosa leaves showed the larger zone of inhibition in aqueous and butanolic extract respectively against Escherichia coli. Musa paradisiaca and Murraya koenigii leaves showed larger zone of inhibition in ethanolic extract against S. aureus. Qualitative phytochemical analysis showed the presence of alkaloids, flavonoids, phenols, terpenoids, steroids, glycosides, saponins, carbohydrates, proteins and tannins in all extracts while phylobatannins, emodins, anthocyanins and leucoanthocyanins were not present in these extracts. Quantitative phytochemical analysis showed the highest alkaloid content in the Murraya koenigii leaves. Highest tannin content and flavonoid content was found in Ficus religiosa leaves, while highest phenolic content was found in case of Cassia fistula. In addition to this antioxidant potential of all the extracts was determined. Musa paradisiaca leaves showed highest antioxidant potential as compared to other plant extracts. In silico analysis of bioactive components present in plant extracts was performed by molecular docking. The rutin and Glu from Musa paradisiaca and Murraya koenigii respectively, were docked with Glycogen Synthase Kinase 3 beta (1GSK-3beta) protein. Quercetin and rutin from Cassia fistula and Ficus religiosa respectively, were docked with C- reactive protein (CRP). The tested bioactive compounds showed good binding affinity with significant number of hydrogen bonds and can be used as a good alternative of synthetic drugs to treat rheumatism and wounds.



中文翻译:

不同植物的植物化学和抗菌特性及其在伤口愈合和风湿病中的生物活性化合物的计算机研究

在当前的研究中,对决明、芭蕉、榕树九里香植物提取物的抗菌和植物化学特性进行了评估。测试了这些植物提取物对金黄色葡萄球菌大肠杆菌的抗菌潜力。决明和榕树叶的水提取物和丁醇提取物分别对大肠杆菌表现出较大的抑制区域。芭蕉九里香叶的乙醇提取物对金黄色葡萄球菌表现出较大的抑制区域。定性植物化学分析显示,所有提取物中均存在生物碱、黄酮类、酚类、萜类化合物、类固醇、糖苷、皂苷、碳水化合物、蛋白质和单宁,而这些提取物中不存在叶叶单宁、大黄素、花青素和无色花青素。定量植物化学分析显示九里香叶中生物碱含量最高。榕树叶中单宁含量和类黄酮含量最高,而决明子叶中酚类含量最高。除此之外,还测定了所有提取物的抗氧化潜力。与其他植物提取物相比,芭蕉叶表现出最高的抗氧化潜力。通过分子对接对植物提取物中存在的生物活性成分进行计算机分析。来自Musa paradisiacaMurraya koenigii的芦丁和 Glu分别与糖原合成酶激酶 3 beta (1GSK-3beta) 蛋白对接。分别来自决明榕树的槲皮素和芦丁与 C 反应蛋白 (CRP) 对接。所测试的生物活性化合物表现出良好的结合亲和力,具有大量氢键,可作为合成药物的良好替代品来治疗风湿病和伤口。

更新日期:2024-02-02
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