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对罗氏爵床(爵床科)潜在生物制药应用的深入洞察:化学多样性、体外生物活性及计算分析

Unrivalled Insight into Possible Biopharmaceutical Application of Justicia vahlii Roth. (Acanthaceae): Chemodiversity, In Vitro Bioactivities, and Computational Analysis.

作者信息

Basit Abdul, Ahmad Saeed, Ovatlarnporn Chitchamai, Arshad Muhammad Adeel, Saleem Muhammad Farrukh, Khurshid Umair, Saleem Hammad, Khan Kashif Ur Rehman, Khan Safiullah, Alkahtani Hamad M, Zen Amer Alhaj

机构信息

Department of Pharmaceutical Chemistry, Faculty of Pharmacy, The Islamia University of Bahawalpur, Bahawalpur, Punjab, 63100, Pakistan.

Department of Pharmaceutical Chemistry, Faculty of Pharmaceutical Sciences, Prince of Songkla University, Hat Yai, 90010, Songkhla, Thailand.

出版信息

Chem Biodivers. 2024 Dec;21(12):e202401432. doi: 10.1002/cbdv.202401432. Epub 2024 Oct 23.

DOI:10.1002/cbdv.202401432
PMID:39083693
Abstract

Justicia vahliiRoth. is an important wild medicinal food plant traditionally used for treating inflammation and various common ailments. This study investigated the chemical composition, antioxidant, enzyme inhibition and toxicity profiles of n-hexane (nHEJv) and chloroform (CEJv) extracts of J. vahlii. Moreover, the effect of the extracts was evaluated on CCl induced liver injury. The total phenolic and flavonoid contents were present in both extracts in significant amount. The UPLC-Q-TOF-MS and GC-MS profiling of CEJv tentatively identified several important phytocompounds. The CEJv extract was comparatively more active for antioxidant activity and α-amylase inhibition, whereas the nHEJv extract presented higher inhibition potential against urease, tyrosinase, and α-glucosidase enzymes. Similarly, the in-silicostudy of four major compounds, i. e., 1-acetoxypinoresinol, 3-hydroxysebacic acid, nortrachelogenin, and viscidulin-III have shown a good docking score against the clinically significant enzymes. The acute oral toxicity and brine shrimp lethality assaysrevealed the extracts as non-toxic. The CCl treated animals showed a geared depletion of various antioxidant enzymes which were significantly reversed with the treatment of the extracts. Overall, the study's findings revealed J. vahliiwith antioxidant mediated hepatoprotective and enzyme inhibition potential and warrant further research on isolation of the bioactive compounds.

摘要

瓦氏爵床(Justicia vahlii Roth.)是一种重要的野生药食两用植物,传统上用于治疗炎症和各种常见疾病。本研究调查了瓦氏爵床正己烷提取物(nHEJv)和氯仿提取物(CEJv)的化学成分、抗氧化、酶抑制和毒性特征。此外,还评估了这些提取物对四氯化碳诱导的肝损伤的影响。两种提取物中均含有大量的总酚和黄酮类化合物。CEJv的超高效液相色谱-四极杆飞行时间质谱(UPLC-Q-TOF-MS)和气相色谱-质谱(GC-MS)分析初步鉴定了几种重要的植物化合物。CEJv提取物在抗氧化活性和α-淀粉酶抑制方面相对更具活性,而nHEJv提取物对脲酶、酪氨酸酶和α-葡萄糖苷酶具有更高的抑制潜力。同样,对四种主要化合物,即1-乙酰氧基松脂醇、3-羟基癸二酸、去甲rachelogenin和viscidulin-III的计算机模拟研究表明,它们与临床上重要的酶具有良好的对接分数。急性经口毒性试验和卤虫致死试验表明提取物无毒。四氯化碳处理的动物表现出各种抗氧化酶的明显消耗,而提取物处理可显著逆转这种消耗。总体而言,该研究结果揭示了瓦氏爵床具有抗氧化介导的肝保护和酶抑制潜力,值得进一步研究分离其生物活性化合物。

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