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Phytochemical Analysis and in vivo Toxicity Study of Extracted Walnut oil in Sprague Dawley Rats 核桃油提取物的植物化学分析和对 Sprague Dawley 大鼠的体内毒性研究
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-28 DOI: 10.1177/1934578x241271695
Talar Hamaali Mohammed, Heshu Sulaiman Rahman, Shirwan Hamasalih Omer
Background: Medicinal plants have been the focus of scientific research for many decades worldwide, especially those used in traditional medicine. Objective: To perform the phytochemical analysis of extracted walnut oil (EWO) and its subchronic toxicity profile in Sprague Dawley rats. Methods: In this experimental study, the collected Kurdish walnut was authenticated by an authorized taxonomist and the core was obtained. Then, the walnut oil was extracted using the cold press method and sent for phytochemical analysis using GC-MS. Accordingly, the male Sprague Dawley rats were treated with varying doses of the EWO for four consecutive weeks, and animals were checked daily for abnormality and toxicity behaviours while they were weighed each week. At the end of the study, animals were sacrificed under deep anaesthesia, blood samples and organs were collected, and various hematological and biochemical tests were performed together with histopathological analysis. Results: GC-MS analysis showed that EWO contained 49 compounds, some critical in biomedical fields. The body weight of all treated animals was increased significantly. No significant changes were seen for hematological tests except platelets, which decreased in all treated groups (p = 0.015) compared to the control group. At the same time, AST and chloride levels were decreased (p = 0.002 and p = 0.012, respectively), while total protein and calcium were increased (p = 0.004 and p = 0.033, respectively). Simultaneously, histopathological analysis showed no severe lesions in the brain, moderate lesions in the liver and mild, moderate and severe lesions in the kidneys. Conclusions: EWO is rich in various compounds that contain active medicinal components. The EWO can be used at low doses as it does not affect most hematological and biochemical tests and has no significant toxicity in the vital organs of experimental rats.
背景:几十年来,药用植物一直是全球科学研究的重点,尤其是传统医学中使用的药用植物。研究目的对提取的核桃油(EWO)进行植物化学分析,并分析其对 Sprague Dawley 大鼠的亚慢性毒性。方法:在本实验研究中,采集的库尔德核桃由授权的分类学家鉴定并获得核芯。然后,用冷榨方法提取核桃油,并用气相色谱-质谱仪进行植物化学分析。因此,雄性 Sprague Dawley 大鼠连续四周接受不同剂量的 EWO 治疗,每周称重,每天检查动物是否有异常和毒性行为。研究结束时,在深度麻醉下将大鼠处死,收集血液样本和器官,并进行各种血液学和生化测试以及组织病理学分析。研究结果气相色谱-质谱分析表明,EWO 含有 49 种化合物,其中一些对生物医学领域至关重要。所有治疗动物的体重都有明显增加。与对照组相比,除血小板减少(p = 0.015)外,血液学检测未见明显变化。同时,谷草转氨酶和氯化物水平下降(分别为 p = 0.002 和 p = 0.012),而总蛋白和钙增加(分别为 p = 0.004 和 p = 0.033)。同时,组织病理学分析表明,大脑没有严重病变,肝脏有中度病变,肾脏有轻度、中度和重度病变。结论枇杷膏富含多种化合物,其中含有活性药用成分。由于 EWO 不影响大多数血液学和生化测试,对实验大鼠的重要器官也没有明显毒性,因此可以小剂量使用。
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引用次数: 0
Bioactivities and Toxicity of the Golden Camellia Species: A Systematic Review 金茶花品种的生物活性和毒性:系统综述
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-26 DOI: 10.1177/1934578x241278133
Minh-Nhut Truong, The-Long Pham, Tram-Anh Mai Pham, Van-Dat Truong, Linh-Tu Vo, Thao-My Nguyen-Hoang, Lac-Thuy Nguyen-Huu
Golden camellia, a group of herbal materials belonging to the Theaceae family, was widely distributed in Asian countries, particularly Vietnam and southern China. Numerous pharmacological effects of various golden camellia species have been reported in reputable databases such as PubMed and Google Scholar. These effects included anti-tumor, lipid-lowering, anxiolytic, antidepressant, neuroprotective, antioxidant, antibacterial, and anti-inflammatory properties. Furthermore, toxicity studies on golden camellia species have demonstrated their safety for use. Our systematic review provides a comprehensive understanding of the pharmacological effects and safety of various golden camellia species, aiming to provide reliable evidence for the clinical use of this herbal material.
金山茶花属于山茶科草本植物,广泛分布于亚洲国家,尤其是越南和中国南部。PubMed 和谷歌学术等知名数据库已报道了多种金花茶的药理作用。这些功效包括抗肿瘤、降血脂、抗焦虑、抗抑郁、神经保护、抗氧化、抗菌和抗炎特性。此外,对金花茶物种的毒性研究也证明了其使用的安全性。我们的系统综述全面介绍了各种金花茶品种的药理作用和安全性,旨在为这种草药材料的临床应用提供可靠的证据。
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引用次数: 0
Study on the Possibility of Developing Functional Source Through Extraction Optimization of Schinus terebinthifolia Bark and Evaluation of Anti-Oxidant, Elastase Inhibitory and Xanthine Oxidase Inhibitory Effect 关于通过优化栲胶开发功能源的可能性以及评估抗氧化剂、弹性蛋白酶抑制剂和黄嘌呤氧化酶抑制剂效果的研究
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-22 DOI: 10.1177/1934578x241275016
Seung-Yub Song, Sung-Ho Lee, Jin-Woo Park, Dae-Hun Park, Seung-Sik Cho
Introduction: Schinus terebinthifolia (ST) is a plant belonging to the cashew family Anacardiaceae, native to subtropical and tropical South America. ST is commonly called Brazil pepper and aroeira. Several reports have been made on the biological activities of ST, but studies on leaf extracts, especially lectins, have mainly been reported. Objectives: Our study analyzed the active compounds, antioxidant activities, xanthine oxidase inhibitory, elastase inhibitory, and tyrosinase inhibitory activities of S. terebinthifolia (ST) bark extract. Results: Hot water extracts showed the strongest electron donating ability (84.46%) and tyrosinase inhibitory activity (67.1%). Eighty percent ethanol extract showed the highest reducing power, total phenolic, xanthine oxidase (91.7%) and elastase inhibitory ability (85.44%). Catechin, α–amyrin, β–amyrone and 11-Oxo-.α-amyrin were identified through HPLC and GCMS analysis, while eighty percent extract contained the highest amount of catechin. Catechin, α–amyrin, and β–amyrone are considered to be the main xanthine oxidase inhibitors, while β–amyrone is considered to be the main inhibitor of xanthine oxidase and elastase. Conclusion: Through this study, we reported the basic information that S. terebinthifolia bark extract was used in folk medicine as an anti-inflammatory, anti-gout, and skin disease improvement material. S. terebinthifolia bark extract could be used as an anti-gout natural drug or cosmetic material.
简介Schinus terebinthifolia(ST)是一种属于腰果科 Anacardiaceae 的植物,原产于亚热带和热带南美洲。ST 通常被称为巴西胡椒和巴西芹。关于 ST 的生物活性已有多篇报道,但主要是关于叶提取物,特别是凝集素的研究。研究目的我们的研究分析了 S. terebinthifolia(ST)树皮提取物的活性化合物、抗氧化活性、黄嘌呤氧化酶抑制活性、弹性蛋白酶抑制活性和酪氨酸酶抑制活性。结果热水提取物显示出最强的电子捐赠能力(84.46%)和酪氨酸酶抑制活性(67.1%)。80% 的乙醇提取物显示出最高的还原力、总酚、黄嘌呤氧化酶(91.7%)和弹性蛋白酶抑制能力(85.44%)。通过 HPLC 和 GCMS 分析确定了儿茶素、α-amyrin、β-amyrone 和 11-氧-.α-amyrin,而 80% 的提取物中儿茶素含量最高。儿茶素、α-amyrin 和 β-amyrone 被认为是主要的黄嘌呤氧化酶抑制剂,而 β-amyrone 被认为是黄嘌呤氧化酶和弹性蛋白酶的主要抑制剂。结论:通过本研究,我们报告了 S. terebinthifolia 树皮提取物在民间医学中用作抗炎、抗痛风和改善皮肤病材料的基本信息。蛇床子树皮提取物可用作抗痛风的天然药物或化妆品原料。
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引用次数: 0
Rigidone or ent-perezone? 硬质酮还是烯丙酮?
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-22 DOI: 10.1177/1934578x241276965
Ma Alvina Bucio-Vásquez, Miguel Ángel Fuentes-Figueroa, Angelina Hernández-Barragan, Luis Gerardo Zepeda-Vallejo, Eleuterio Burgueño-Tapia, Pedro Joseph-Nathan
IntroductionThe 13C-NMR data described for perezone (1), a 3-hydroxy p-quinone stated as the first natural product isolated as crystals in the New World, and rigidone (2), a 4-hydroxy o-quinone isolated from a coral species, are essentially the same. Some years ago, we described, using theoretical calculations, that a 4-hydroxy-1,2-quinone is more than 11 kcal/mol less stable than a 3-hydroxy-1,4-quinone making coexistence in nature of this type of quinones. In the present study, we approach the situation by comparing of the experimental 13C-NMR data for 1 and those described for 2 with the calculated using computational methods. Additional evidence was obtained from a X-ray diffraction analysis for the reaction product of perezone with o-phenylendiamine.MethodsThe 13C-NMR data for the quinoid rings were calculated using the GIAO and CSGT methods, density functional theory (DFT) and the functional/basis set pairs B3LYP/6-31 g(d,p) and MPW1PW91/6-31 g(d,p); and TPSSTPSS/cc-PVTZ and PBE1PBE/aug-cc-PVDZ. Perezone reaction with o-phenylenediamine was achieved using a described method in MeOH at room temperature. X-Ray diffraction analysis of phenazine from perezone reaction was done using Mo Kα radiation. The data were used to calculate the Flack parameter.ResultsAfter conformational analysis, complete optimization of the geometry of the conformers found and, calculation of the 13C-NMR chemical shifts for the quinone ring of 1 and 2, in all cases a better agreement was observed between the experimental data for 1 versus 2. Perezone reaction with o-phenylenediamine afforded the corresponding phenazine in its amine-keto tautomeric form as evidenced from a X-ray diffraction study.ConclusionThe better agreement observed between the experimental and calculated data for 1 versus 2, along with the free energy difference of more than 11 kcal/mol in favor of the 3-hydroxy p-quinone versus 4-hydroxy o-quinone, previously established for us, allow to say that the structure described for rigidone corresponds to ent -perezone.
引言 perezone (1) 是一种 3- 羟基对醌,被称为在新世界中分离出的第一种天然晶体产品,而 rigidone (2) 则是从一种珊瑚物种中分离出的 4- 羟基邻醌,两者的 13C-NMR 数据基本相同。几年前,我们曾通过理论计算指出,4-羟基-1,2-醌的稳定性比 3-羟基-1,4-醌低 11 kcal/mol 以上,因此这一类醌在自然界中是共存的。在本研究中,我们将 1 和 2 的 13C-NMR 实验数据与计算方法计算出的数据进行了比较。方法使用 GIAO 和 CSGT 方法、密度泛函理论(DFT)、B3LYP/6-31 g(d,p) 和 MPW1PW91/6-31 g(d,p);以及 TPSSTPSS/cc-PVTZ 和 PBE1PBE/aug-cc-PVDZ 计算了醌环的 13C-NMR 数据。采用所述方法,在室温下于 MeOH 中实现了腙与邻苯二胺的反应。使用 Mo Kα 辐射对腙反应生成的酚嗪进行了 X 射线衍射分析。结果经过构象分析、对所发现构象的几何形状进行完全优化以及计算 1 和 2 的醌环的 13C-NMR 化学位移后,在所有情况下都观察到 1 与 2 的实验数据更加一致。结论 1 与 2 的实验数据和计算数据之间的一致性较好,加上我们之前确定的 3-hydroxy p-quinone 与 4-hydroxy o-quinone 之间的自由能差超过 11 kcal/mol,因此可以说僵化酮所描述的结构与 ent -perezone 相符。
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引用次数: 0
Kaempferol Protects Pulmonary Vascular Endothelial Function in Rats with High Altitude Pulmonary Hypertension by Regulating RAS System and AMPK/Arg2/eNOS Signaling Pathway 山奈酚通过调节 RAS 系统和 AMPK/Arg2/eNOS 信号通路保护高海拔肺动脉高压大鼠的肺血管内皮功能
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-22 DOI: 10.1177/1934578x241274896
Xin Xie, Huiru Li, Liangqi Wang, Xiaonan Zhang, Dianxiang Lu, Zhanqiang Li
BackgroundPrevious studies have found that kaempferol can relieve pulmonary hypertension (PH).ObjectiveExplore the protective impact of kaempferol on pulmonary vascular endothelium in rats with high altitude pulmonary hypertension (HAPH).Materials and methodsIn a simulated altitude of 5000 m environment, rats were induced to develop HAPH after continuous intragastric administration of kaempferol (25, 50 and 100 mg·kg−1) and Sildenafil (30 mg·kg−1) for 28 days. Assessment of isolated pulmonary arterial rings in rats and relevant indicators in lung tissue was performed, with the mechanism of action investigated using Western blotting.ResultsKaempferol effectively dilates rat pulmonary arterial rings, with an EC50 of 55.75 μmol/L. L-NAME can effectively counteract the vasodilatory effect of kaempferol. Acetylcholine demonstrated better relaxation of pulmonary arterial rings in HAPH rats after kaempferol intervention. Elastic Van Gieson staining (EVG) and immunohistochemistry (CD31) results indicate that kaempferol can partially protect pulmonary vascular endothelial function in HAPH rats. Western blotting reveals that kaempferol has the ability to regulate the Renin-Angiotensin System (RAS). This leads to a compensatory increase in eNOS expression, upregulation of AMPK activity, and downregulation of eNOS monomer/dimer levels.ConclusionsKaempferol can improve pulmonary vascular endothelial dysfunction caused by chronic hypoxia by upregulating the phosphorylation level of AMPK, regulating the RAS system, and inhibiting eNOS uncoupling, thereby achieving vasodilation and endothelial protection.
背景先前的研究发现山奈酚可以缓解肺动脉高压(PH).目的探讨山奈酚对高海拔肺动脉高压(HAPH)大鼠肺血管内皮的保护作用.材料和方法在模拟海拔5000 m的环境中,连续胃内给予山奈酚(25、50和100 mg-kg-1)和西地那非(30 mg-kg-1)28天,诱导大鼠发生HAPH。结果 山奈酚能有效扩张大鼠肺动脉环,EC50 为 55.75 μmol/L。L-NAME 能有效抵消山奈酚的血管扩张作用。山奈酚干预后,乙酰胆碱能更好地松弛 HAPH 大鼠的肺动脉环。弹性范吉森染色(EVG)和免疫组化(CD31)结果表明,山奈酚能部分保护 HAPH 大鼠的肺血管内皮功能。Western 印迹分析表明,山奈酚具有调节肾素-血管紧张素系统(RAS)的能力。结论山奈酚可以通过上调 AMPK 磷酸化水平、调节 RAS 系统和抑制 eNOS 解偶联来改善慢性缺氧引起的肺血管内皮功能障碍,从而达到扩张血管和保护内皮的目的。
{"title":"Kaempferol Protects Pulmonary Vascular Endothelial Function in Rats with High Altitude Pulmonary Hypertension by Regulating RAS System and AMPK/Arg2/eNOS Signaling Pathway","authors":"Xin Xie, Huiru Li, Liangqi Wang, Xiaonan Zhang, Dianxiang Lu, Zhanqiang Li","doi":"10.1177/1934578x241274896","DOIUrl":"https://doi.org/10.1177/1934578x241274896","url":null,"abstract":"BackgroundPrevious studies have found that kaempferol can relieve pulmonary hypertension (PH).ObjectiveExplore the protective impact of kaempferol on pulmonary vascular endothelium in rats with high altitude pulmonary hypertension (HAPH).Materials and methodsIn a simulated altitude of 5000 m environment, rats were induced to develop HAPH after continuous intragastric administration of kaempferol (25, 50 and 100 mg·kg<jats:sup>−1</jats:sup>) and Sildenafil (30 mg·kg<jats:sup>−1</jats:sup>) for 28 days. Assessment of isolated pulmonary arterial rings in rats and relevant indicators in lung tissue was performed, with the mechanism of action investigated using Western blotting.ResultsKaempferol effectively dilates rat pulmonary arterial rings, with an EC<jats:sub>50</jats:sub> of 55.75 μmol/L. L-NAME can effectively counteract the vasodilatory effect of kaempferol. Acetylcholine demonstrated better relaxation of pulmonary arterial rings in HAPH rats after kaempferol intervention. Elastic Van Gieson staining (EVG) and immunohistochemistry (CD31) results indicate that kaempferol can partially protect pulmonary vascular endothelial function in HAPH rats. Western blotting reveals that kaempferol has the ability to regulate the Renin-Angiotensin System (RAS). This leads to a compensatory increase in eNOS expression, upregulation of AMPK activity, and downregulation of eNOS monomer/dimer levels.ConclusionsKaempferol can improve pulmonary vascular endothelial dysfunction caused by chronic hypoxia by upregulating the phosphorylation level of AMPK, regulating the RAS system, and inhibiting eNOS uncoupling, thereby achieving vasodilation and endothelial protection.","PeriodicalId":19019,"journal":{"name":"Natural Product Communications","volume":"1 1","pages":""},"PeriodicalIF":1.8,"publicationDate":"2024-08-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142177320","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"医学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Characterization and Improvement of Sleep Activity of Ziziphi Spinosae Semen Oil Microcapsules Prepared by Complex Coacervation 复合共凝胶法制备的刺五加精油微胶囊的特性及睡眠活性的改善
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-22 DOI: 10.1177/1934578x241272480
Jiaxin Chen, Xinbo Shi*, Zhishu Tang**, Zhongxing Song, Guolong Li, Hongbo Liu
Objective: Ziziphi Spinosae Semen oil (ZSSO) is a fatty oil extracted from Ziziphi Spinosae Semen, and its main component is unsaturated fatty acid. It is susceptible to oxidation and deterioration. The aim of this study was to improve the stability of ZSSO and protect its quality. Methods: gelatin-sodium alginate was used as the wall material for the preparation of ZSSO microcapsules by the complex coacervation. The particle size and zeta potential of the microcapsules were determined using a Malvern particle size meter. The microstructure and stability of the microcapsules were determined by SEM, FTIR, TGA and PV. The sleep-improving activity of the microcapsules was also determined by sleep induction assay, Elisa and HE staining. Results: The encapsulation efficiency of microcapsules was 56.08% ± 0.19%, average particle size was 166.17 nm, and zeta potential was 38.2. Morphology of microcapsules was observed by SEM. The FTIR results showed that the fatty oil was successfully embedded, and PV indicated that microcapsules had a slow oxidation rate. A preliminary study on the sleep-improving activity of ZSSO and microcapsules demonstrated that it could shorten sleep latency and prolong sleep time of insomniac mice, and increase the levels of 5-HT and GABA and decrease the level of Glu in the brain of mice. In addition, ZSSO and microcapsules can repair damaged neuronal cells in the hypothalamus of insomniac mice to improve sleep. Conclusion: The quality evaluation of the microcapsules indicates that the prepared ZSSO-MPs have a small particle size and good stability. Moreover, ZSSO and microcapsules can effectively improve the sleep status of insomnia mice.
目的:刺五加精油(ZSSO)是从刺五加精液中提取的一种脂肪油,其主要成分是不饱和脂肪酸。它很容易氧化和变质。本研究的目的是提高 ZSSO 的稳定性,保护其质量。方法:以明胶-海藻酸钠为壁材,采用复合共凝胶法制备 ZSSO 微胶囊。使用马尔文粒度仪测定微胶囊的粒度和 zeta 电位。微胶囊的微观结构和稳定性由扫描电镜、傅立叶变换红外光谱(FTIR)、热重分析(TGA)和紫外光谱(PV)测定。还通过睡眠诱导试验、Elisa 和 HE 染色测定了微胶囊的睡眠改善活性。结果微胶囊的封装效率为 56.08% ± 0.19%,平均粒径为 166.17 nm,zeta 电位为 38.2。扫描电镜观察了微胶囊的形态。傅立叶变换红外光谱(FTIR)结果表明脂肪油被成功包埋,紫外光谱(PV)结果表明微胶囊的氧化速度较慢。对 ZSSO 和微胶囊改善睡眠活性的初步研究表明,ZSSO 和微胶囊能缩短失眠小鼠的睡眠潜伏期,延长睡眠时间,并能提高小鼠脑内 5-HT 和 GABA 的水平,降低 Glu 的水平。此外,ZSSO 和微胶囊还能修复失眠小鼠下丘脑中受损的神经元细胞,从而改善睡眠。结论微胶囊的质量评价表明,制备的 ZSSO-MPs 粒径小、稳定性好。此外,ZSSO 和微胶囊能有效改善失眠小鼠的睡眠状况。
{"title":"Characterization and Improvement of Sleep Activity of Ziziphi Spinosae Semen Oil Microcapsules Prepared by Complex Coacervation","authors":"Jiaxin Chen, Xinbo Shi*, Zhishu Tang**, Zhongxing Song, Guolong Li, Hongbo Liu","doi":"10.1177/1934578x241272480","DOIUrl":"https://doi.org/10.1177/1934578x241272480","url":null,"abstract":"Objective: Ziziphi Spinosae Semen oil (ZSSO) is a fatty oil extracted from Ziziphi Spinosae Semen, and its main component is unsaturated fatty acid. It is susceptible to oxidation and deterioration. The aim of this study was to improve the stability of ZSSO and protect its quality. Methods: gelatin-sodium alginate was used as the wall material for the preparation of ZSSO microcapsules by the complex coacervation. The particle size and zeta potential of the microcapsules were determined using a Malvern particle size meter. The microstructure and stability of the microcapsules were determined by SEM, FTIR, TGA and PV. The sleep-improving activity of the microcapsules was also determined by sleep induction assay, Elisa and HE staining. Results: The encapsulation efficiency of microcapsules was 56.08% ± 0.19%, average particle size was 166.17 nm, and zeta potential was 38.2. Morphology of microcapsules was observed by SEM. The FTIR results showed that the fatty oil was successfully embedded, and PV indicated that microcapsules had a slow oxidation rate. A preliminary study on the sleep-improving activity of ZSSO and microcapsules demonstrated that it could shorten sleep latency and prolong sleep time of insomniac mice, and increase the levels of 5-HT and GABA and decrease the level of Glu in the brain of mice. In addition, ZSSO and microcapsules can repair damaged neuronal cells in the hypothalamus of insomniac mice to improve sleep. Conclusion: The quality evaluation of the microcapsules indicates that the prepared ZSSO-MPs have a small particle size and good stability. Moreover, ZSSO and microcapsules can effectively improve the sleep status of insomnia mice.","PeriodicalId":19019,"journal":{"name":"Natural Product Communications","volume":"9 1","pages":""},"PeriodicalIF":1.8,"publicationDate":"2024-08-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142177324","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"医学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Exploring the Potential Pharmacological Basis and Mechanism of HJT Activity in the Treatment of CHD Based on UPLC-QE-MS and Network Pharmacology 基于UPLC-QE-MS和网络药理学探索HJT治疗冠心病的潜在药理基础和机制
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-22 DOI: 10.1177/1934578x241275005
Wang Qi, Zhong Jianyuan, Zhang Wenxia, Ren Yinghan, Yang Yang
ObjectiveTo identify the blood-entering components of HanJing Decoction (HJT) after administration based on UPLC-QE-MS/MS, and the key components, therapeutic targets and mechanisms of HJT therapeutic coronary heart disease (CHD) were analyzed using network pharmacology and molecular docking.MethodThe UPLC-QE-MS/MS was used to analyze the blood-entering components of HJT before and after administration. The targets of blood-entering components were predicted by SwissTargetPrediction. Targets related to CHD were collected using multiple databases. The GO and KEGG enrichment analyses were used to predict the mechanisms of HJT therapeutic CHD, and PPI and “Components-Targets-Pathways” network were used to identify and elucidate the core targets. The key blood-entering components aimed at the core target are screened by molecular docking and QSAR analysis.ResultsA total of 14 blood-entering components were detected in serum samples of rat after administration, and the 32 potential targets of HJT therapeutic CHD were screened out. The result of PPI network showed that the core targets of HJT for the treatment of CHD include MMP1, GSK3B, EGFR and PTGS2, and the 5 key components with high degree were screened out. The GO and KEGG enrichment analyses indicate that HJT therapy for CHD is associated with the IL-17 and cGMP-PKG signaling pathways. The result of molecular docking indicate that the binding energy of coroglaucigenin to PTGS2 is the largest and it may be the key pharmacological component of HJT, and the QSAR analysis showed that Boldine and Coroglaucigenin had excellent activity in inhibiting PTGS2.ConclusionsIn this study, the blood-entering components of HJT were preliminarily identified, Combined network pharmacology and molecular docking analyses revealed that the PTGS2 may be a core target, and the IL-17 and cGMP-PKG signaling pathways may be the key pathways. Moreover, the coroglaucigenin and boldine may be the key pharmacological components of HJT.
方法采用UPLC-QE-MS/MS分析汉防己汤用药前后的入血成分。利用SwissTargetPrediction预测入血成分的靶点。利用多个数据库收集了与 CHD 相关的靶标。利用GO和KEGG富集分析预测HJT治疗冠心病的机制,并利用PPI和 "成分-靶点-通路 "网络确定和阐明核心靶点。结果 在大鼠给药后的血清样本中检测到14种入血成分,筛选出32个HJT治疗性心脏病的潜在靶点。PPI网络结果显示,HJT治疗CHD的核心靶点包括MMP1、GSK3B、表皮生长因子受体(EGFR)和PTGS2,并筛选出了5个高度关键的靶点成分。GO和KEGG富集分析表明,HJT治疗CHD与IL-17和cGMP-PKG信号通路有关。分子对接结果表明 Coroglaucigenin 与 PTGS2 的结合能最大,可能是 HJT 的关键药理成分,QSAR 分析表明 Boldine 和 Coroglaucigenin 对 PTGS2 有很好的抑制活性。结论本研究初步确定了HJT的入血成分,结合网络药理学和分子对接分析发现,PTGS2可能是核心靶点,IL-17和cGMP-PKG信号通路可能是关键通路。此外,珊瑚甙元和波胆碱可能是 HJT 的关键药理成分。
{"title":"Exploring the Potential Pharmacological Basis and Mechanism of HJT Activity in the Treatment of CHD Based on UPLC-QE-MS and Network Pharmacology","authors":"Wang Qi, Zhong Jianyuan, Zhang Wenxia, Ren Yinghan, Yang Yang","doi":"10.1177/1934578x241275005","DOIUrl":"https://doi.org/10.1177/1934578x241275005","url":null,"abstract":"ObjectiveTo identify the blood-entering components of HanJing Decoction (HJT) after administration based on UPLC-QE-MS/MS, and the key components, therapeutic targets and mechanisms of HJT therapeutic coronary heart disease (CHD) were analyzed using network pharmacology and molecular docking.MethodThe UPLC-QE-MS/MS was used to analyze the blood-entering components of HJT before and after administration. The targets of blood-entering components were predicted by SwissTargetPrediction. Targets related to CHD were collected using multiple databases. The GO and KEGG enrichment analyses were used to predict the mechanisms of HJT therapeutic CHD, and PPI and “Components-Targets-Pathways” network were used to identify and elucidate the core targets. The key blood-entering components aimed at the core target are screened by molecular docking and QSAR analysis.ResultsA total of 14 blood-entering components were detected in serum samples of rat after administration, and the 32 potential targets of HJT therapeutic CHD were screened out. The result of PPI network showed that the core targets of HJT for the treatment of CHD include MMP1, GSK3B, EGFR and PTGS2, and the 5 key components with high degree were screened out. The GO and KEGG enrichment analyses indicate that HJT therapy for CHD is associated with the IL-17 and cGMP-PKG signaling pathways. The result of molecular docking indicate that the binding energy of coroglaucigenin to PTGS2 is the largest and it may be the key pharmacological component of HJT, and the QSAR analysis showed that Boldine and Coroglaucigenin had excellent activity in inhibiting PTGS2.ConclusionsIn this study, the blood-entering components of HJT were preliminarily identified, Combined network pharmacology and molecular docking analyses revealed that the PTGS2 may be a core target, and the IL-17 and cGMP-PKG signaling pathways may be the key pathways. Moreover, the coroglaucigenin and boldine may be the key pharmacological components of HJT.","PeriodicalId":19019,"journal":{"name":"Natural Product Communications","volume":"59 1","pages":""},"PeriodicalIF":1.8,"publicationDate":"2024-08-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142177318","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"医学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Exploring the Bioactivity of Siddhalepa Asamodagam Spirit from Seeds of Trachyspermum roxburghianum (DC.) H. Wolff 探索从Trachyspermum roxburghianum (DC.) H. Wolff种子中提取的Siddhalepa Asamodagam精神的生物活性
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-21 DOI: 10.1177/1934578x241271629
Dilan Jayawantha, Lankani Hettigoda, Tharindya Dinethri Mudalige, Priyani Ashoka Paranagama
ObjectivesThe water distillate derived from Trachyspermum roxburghianum seeds has been traditionally employed in medicine for treating stomach infections and gastric ulcers. However, no systematic study has been conducted to evaluate its efficacy. Therefore, the present study focused on evaluating the potential health benefits, including the chemical constituents of the distillate. This distillate was prepared and identified as Siddhalepa Asamodagam Spirit (Sid.AS).MethodsThe chemical constituents of Sid.AS were identified and quantified using Gas Chromatography-Mass Spectrometry (GC-MS) method. The antioxidant potential of Sid.AS samples was assessed in vitro using DPPH and ABTS assays. Various concentrations of Sid.AS were subjected to antimicrobial, anti-obesity, anti-diabetic, anti-inflammatory, and urease inhibition assays according to the standard methods specified by the Ayurvedic Department in Sri Lanka.ResultsThymol was identified as the major compound in Sid.AS through GC-MS analysis. Sid.AS demonstrated significant anti-urease, anti-inflammatory, anti-lipase, and antioxidant activities, as evidenced by low IC50 values compared to the positive controls. This suggests its potential in controlling gastric-related disorders, scavenging free radicals, and managing obesity by inhibiting the breakdown and absorption of fats. Additionally, Sid.AS exhibited inhibitory effects against alpha-amylase and alpha-glucosidase enzymes, indicating potential anti-diabetic activity by regulating blood sugar levels. Sid.AS displayed strong antimicrobial activity against tested microorganisms, with higher zones of inhibition and lower MIC and MLC values, indicating its effectiveness in combating microbial infections. Findings from the anti-lipase assay demonstrated activity comparable to that of the positive control, Orlistat.ConclusionThe findings of Sid.AS suggest its potential as a multi-functional bioactive herbal distillate with various pharmacological activities. Our results highlight that Sid.AS is a promising natural herbal extract with diverse pharmacological properties, including anti-urease, antioxidant, anti-inflammatory, anti-diabetic, anti-obesity, and antimicrobial activities. Further research and development could explore its potential applications in various therapeutic areas.
目的 从罗布麻种子中提取的水蒸馏物历来被用于治疗胃部感染和胃溃疡。然而,目前还没有系统的研究来评估其功效。因此,本研究侧重于评估其潜在的健康益处,包括蒸馏物的化学成分。方法采用气相色谱-质谱法(GC-MS)对 Sid.AS 的化学成分进行鉴定和定量。采用 DPPH 和 ABTS 法对 Sid.AS 样品的抗氧化潜力进行体外评估。根据斯里兰卡阿育吠陀部规定的标准方法,对不同浓度的 Sid.AS 进行了抗菌、抗肥胖、抗糖尿病、抗炎和尿素酶抑制试验。与阳性对照组相比,Sid.AS 的 IC50 值较低,表明它具有明显的抗尿酸酶、抗炎、抗脂肪酶和抗氧化活性。这表明它在控制胃相关疾病、清除自由基以及通过抑制脂肪的分解和吸收来控制肥胖症方面具有潜力。此外,Sid.AS 还具有抑制α-淀粉酶和α-葡萄糖苷酶的作用,这表明它具有通过调节血糖水平来抗糖尿病的潜在活性。Sid.AS 对测试微生物具有很强的抗菌活性,抑制区更大,MIC 和 MLC 值更低,表明其在抗微生物感染方面具有很强的功效。结论 Sid.AS 的研究结果表明,它具有作为多功能生物活性草药蒸馏物的潜力,具有多种药理活性。我们的研究结果表明,Sid.AS 是一种前景广阔的天然草药提取物,具有多种药理特性,包括抗尿酸酶、抗氧化、抗炎、抗糖尿病、抗肥胖和抗菌活性。进一步的研究和开发可以探索其在各种治疗领域的潜在应用。
{"title":"Exploring the Bioactivity of Siddhalepa Asamodagam Spirit from Seeds of Trachyspermum roxburghianum (DC.) H. Wolff","authors":"Dilan Jayawantha, Lankani Hettigoda, Tharindya Dinethri Mudalige, Priyani Ashoka Paranagama","doi":"10.1177/1934578x241271629","DOIUrl":"https://doi.org/10.1177/1934578x241271629","url":null,"abstract":"ObjectivesThe water distillate derived from Trachyspermum roxburghianum seeds has been traditionally employed in medicine for treating stomach infections and gastric ulcers. However, no systematic study has been conducted to evaluate its efficacy. Therefore, the present study focused on evaluating the potential health benefits, including the chemical constituents of the distillate. This distillate was prepared and identified as Siddhalepa Asamodagam Spirit (Sid.AS).MethodsThe chemical constituents of Sid.AS were identified and quantified using Gas Chromatography-Mass Spectrometry (GC-MS) method. The antioxidant potential of Sid.AS samples was assessed in vitro using DPPH and ABTS assays. Various concentrations of Sid.AS were subjected to antimicrobial, anti-obesity, anti-diabetic, anti-inflammatory, and urease inhibition assays according to the standard methods specified by the Ayurvedic Department in Sri Lanka.ResultsThymol was identified as the major compound in Sid.AS through GC-MS analysis. Sid.AS demonstrated significant anti-urease, anti-inflammatory, anti-lipase, and antioxidant activities, as evidenced by low IC<jats:sub>50</jats:sub> values compared to the positive controls. This suggests its potential in controlling gastric-related disorders, scavenging free radicals, and managing obesity by inhibiting the breakdown and absorption of fats. Additionally, Sid.AS exhibited inhibitory effects against alpha-amylase and alpha-glucosidase enzymes, indicating potential anti-diabetic activity by regulating blood sugar levels. Sid.AS displayed strong antimicrobial activity against tested microorganisms, with higher zones of inhibition and lower MIC and MLC values, indicating its effectiveness in combating microbial infections. Findings from the anti-lipase assay demonstrated activity comparable to that of the positive control, Orlistat.ConclusionThe findings of Sid.AS suggest its potential as a multi-functional bioactive herbal distillate with various pharmacological activities. Our results highlight that Sid.AS is a promising natural herbal extract with diverse pharmacological properties, including anti-urease, antioxidant, anti-inflammatory, anti-diabetic, anti-obesity, and antimicrobial activities. Further research and development could explore its potential applications in various therapeutic areas.","PeriodicalId":19019,"journal":{"name":"Natural Product Communications","volume":"88 1","pages":""},"PeriodicalIF":1.8,"publicationDate":"2024-08-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142177325","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":4,"RegionCategory":"医学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Jiangzhi Paizhuo Decoction Combined with Silibinin Capsules Improve the Outcomes of Metabolic Associated Fatty Liver Disease 绛芝白术汤联合西利宾胶囊改善代谢相关性脂肪肝的疗效
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-16 DOI: 10.1177/1934578x241274900
Jianmei Hao, Yuanjing Xie, Zhiping Yang, Jianwei Dou, Minghua Mao, Xiaofang Li
The study aimed to evaluate the impact of combining silibinin capsules with Jiangzhi Paizhuo Decoction (JZPZ) versus silibinin capsules alone in patients with MAFLD. The research was carried out at the Xi'an Hospital of Traditional Chinese Medicine using a case-control design following to STROBE guideline. Eligible participants meeting the inclusion criteria were randomly allocated into two groups. The participants in control group and intervention group were assigned to receive oral administration of 70 mg (3 times daily) silibinin capsules or 70 mg silibinin capsules (3 times daily) plus colon dialysis with 150 ml JZPZ decoction for 8 weeks. The primary outcome and secondary outcome on the effects of JZPZ decoction in MAFLD were detected. We found that liver function significantly improved in both groups after treatment (p < 0.05) compared with the baseline. Importantly, JZPZ decoction was associated with significant decrease in hepatic steatosis (CAP changes: −18.91 ± 11.50 vs −26.86 ± 16.62, P = 0.0305). The JZPZ decoction reduced significantly the TCM syndromes score compared to control (−5.74 ± 0.95 versus −7.17 ± 1.23, P < 0.0001). Meanwhile, the weight and BMI in JZPZ group increased significantly more than control group (P = 0.0003, P < 0.0001). In conclusion, the JZPZ decoction combined with silibinin capsules in the treatment of MAFLD patients with liver depression and heat syndrome has more advantages in decreasing hepatic steatosis and TCM syndromes scores. It is worthy of clinical recommendation.
该研究旨在评估西利宾胶囊与绛芝白术煎剂(JZPZ)联合与单独服用西利宾胶囊对MAFLD患者的影响。该研究在西安市中医医院进行,采用病例对照设计,符合 STROBE 指南。符合纳入标准的合格参与者被随机分为两组。对照组和干预组分别接受口服70毫克(每日3次)水飞蓟素胶囊或70毫克水飞蓟素胶囊(每日3次)加150毫升JZPZ煎剂的结肠透析,为期8周。我们检测了 JZPZ 水煎剂治疗 MAFLD 的主要结果和次要结果。我们发现,与基线相比,治疗后两组患者的肝功能均有明显改善(p < 0.05)。重要的是,JZPZ煎剂与肝脏脂肪变性的显著下降有关(CAP变化:-18.91 ± 11.50 vs -26.86 ± 16.62,P = 0.0305)。与对照组相比,JZPZ 水煎剂明显降低了中医综合征评分(-5.74 ± 0.95 vs -7.17 ± 1.23,P < 0.0001)。同时,JZPZ组的体重和BMI比对照组明显增加(P = 0.0003,P < 0.0001)。综上所述,JZPZ煎剂联合西利宾胶囊治疗MAFLD肝郁化火证患者,在降低肝脂肪变性和中医证候评分方面更具优势,值得临床推荐。值得临床推荐。
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引用次数: 0
Encapsulation of Pomelo Peel Essential oil (Citrus maxima) Using the Alginate/Chitosan complex 利用海藻酸/壳聚糖复合物封装柚子皮精油(Citrus maxima)
IF 1.8 4区 医学 Q4 CHEMISTRY, MEDICINAL Pub Date : 2024-08-14 DOI: 10.1177/1934578x241275015
Cam Ngan Thi Nguyen, Thuong Nhan Phu Nguyen, Chi Khang Van, Huynh Cang Mai
Objective: This study aimed to determine appropriate parameters for encapsulating pomelo peel essential oil (Citrus maxima) using the alginate/chitosan complex. Methods: The investigated parameters included the concentration of sodium alginate solution (2 ‒ 3.5% w/v based on the volume of mixture), the concentration of pomelo essential oil (20 ‒ 40% w/w based on dry matter of wall marerials), the concentration of Tween 80 (0 ‒ 20% w/w based on dry matter of wall marerials), the concentration of CaCl2 solution (0.5 ‒ 3.5% w/v based on the volume of mixture), time (10 min – 20 min) and speed of emulsion homogenization (489-4402 × g), the concentration of chitosan solution (0.5 ‒ 2% w/v based on the volume of mixture), and pH of chitosan solution (4 ‒ 6). Results: The results showed encapsulation yield (EY%) and encapsulation efficiency (EE%) of 91.64% and 85.18%, respectively, when using the concentration of sodium alginate solution as 3% (w/v based on the volume of mixture), the concentration of essential oil as 30% (w/w based on dry matter of wall marerials), the concentration of Tween 80 as 15% (w/w based on dry matter of wall marerials), the concentration of CaCl2 solution as 1.5% (w/v based on the volume of mixture), homogenization time as 10 min and homogenization speed as 4402 × g, the concentration of chitosan as 2% (w/v based on the volume of mixture) and pH of Chitosan solution as 5. Conclusion: The alginate/chitosan complex was proven effective in encapsulating pomelo essential oil (Citrus maxima) on a laboratory scale. The resulting encapsulated particles had a relatively uniform size and a high ability to retain essential oils in the core of the particles. Further studies should be conducted to elucidate the mechanism of the encapsulation process and to additionally evaluate the physical and chemical properties of the encapsulated particles.
研究目的本研究旨在确定使用海藻酸盐/壳聚糖复合物封装柚子皮精油(Citrus maxima)的适当参数。研究方法研究参数包括海藻酸钠溶液的浓度(按混合物体积计算为 2 - 3.5% w/v)、柚子精油的浓度(按壁材干物质计算为 20 - 40% w/w)、吐温 80 的浓度(按壁材干物质计算为 0 - 20% w/w)、氯化钙溶液的浓度(按壁材干物质计算为 0.5 - 3.5% w/v(基于混合物体积)、乳液均质时间(10 - 20 分钟)和速度(489-4402 × g)、壳聚糖溶液浓度(0.5 - 2% w/v(基于混合物体积))和壳聚糖溶液的 pH 值(4 - 6)。结果显示结果表明,当海藻酸钠溶液浓度为 3% (按混合物体积计算)、香精油浓度为 30% (按墙面干物质计算)、吐温 80 浓度为 15% (按墙面干物质计算)、氯化钙溶液浓度为 1.5%(按混合物体积计算),均质时间为 10 分钟,均质速度为 4402×g,壳聚糖浓度为 2%(按混合物体积计算),壳聚糖溶液的 pH 值为 5:实验证明,海藻酸盐/壳聚糖复合物能有效封装柚子精油(Citrus maxima)。封装后的颗粒大小相对均匀,在颗粒核心保留精油的能力很强。应开展进一步研究,以阐明封装过程的机理,并对封装颗粒的物理和化学特性进行额外评估。
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引用次数: 0
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Natural Product Communications
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