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Simultaneous quantification of hyoscyamine and scopolamine using HPLC-DAD in four Solanaceae: Hyoscyamus niger, Datura stramonium, Atropa belladonna and Mandragora officinarum 用HPLC-DAD同时定量四种茄科植物中的山莨菪碱和东莨菪碱:黑山莨菪碱、曼陀罗、颠茄和曼陀罗。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2269595
Diletta Piatti , Riccardo Marconi , Simone Angeloni , Giovanni Caprioli , Filippo Maggi , Emanuele Ribatti , Vittorio Cattaneo , Gianni Sagratini
Alkaloids are a group of secondary metabolites that generate great interest since ancient times. Numerous Solanaceae plants are rich sources of tropane alkaloids as hyoscyamine and scopolamine which are obtained mainly from Hyoscyamus niger, Datura stramonium, Atropa belladonna, Mandragora officinarum. In the present study it was developed an HPLC-DAD using an XBridge Phenyl column for the quantification of scopolamine and hyoscyamine, molecules used in pharmaceutical industry to treat stomach or intestinal disorders. A. belladonna presented hyoscyamine and scopolamine, the first one ranged from 1466 to 5117 mg/Kg DW while the second one ranged from 140 to 1743 mg/Kg DW. In D. stramonium, hyoscyamine was not found while scopolamine ranged from 430 to 8980 mg/Kg DW. On the contrary H. niger and M. officinarum did not contain any trace of these alkaloids. This is the first work in which different parts of four Solanaceae were analysed for their hyoscyamine and scopolamine content.
生物碱是一组次生代谢产物,自古以来就引起人们的极大兴趣。茄科植物中含有丰富的莨菪生物碱,主要来源于玄参、曼陀罗、颠茄、珙桐。在本研究中,使用XBridge Phenyl柱开发了一种HPLC-DAD,用于定量东莨菪碱和山莨菪碱,这些分子在制药工业中用于治疗胃部或肠道疾病。A.颠茄以山莨菪碱和东莨菪碱为主,第一次用药时间为1466~5117年 mg/Kg DW,而第二个范围为140至1743 mg/Kg DW。在D.stramonium中,没有发现舌草胺,而东莨菪碱的含量在430至8980之间 mg/Kg DW。与此相反,黑曲霉和铁皮石斛不含这些生物碱。这是首次对四种茄科植物的不同部位进行了山莨菪碱和东莨菪碱含量的分析。
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引用次数: 0
Two new sesquiterpenoids from the fruits of Alpinia oxyphylla 从益智果中分离得到两个新的倍半萜类化合物。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2272282
Weirong Bai , Tuanjie Wang , Xiaoming Yang , Zhenzhong Wang , Haibo Li , Jianliang Geng
Two undescribed sesquiterpenoids, including one nor-eudesmane type (1) and one guaiane type (2), together with two known analogues (3-4) have been isolated and identified from the fruits of Alpinia oxyphylla. The structures of these new compounds were elucidated by extensive spectroscopic analyses (1D-, 2D-NMR, HRESIMS, IR, UV) and NMR calculations with DP4+ analysis. The anti-inflammatory activities of all isolates were evaluated by measuring their inhibitory effects on PGE2 production in LPS stimulated RAW 264.7 macrophages.
从益智果中分离并鉴定了两种未描述的倍半萜类化合物,包括一种nor-eusdesmane型(1)和一种guaiane型(2),以及两种已知的类似物(3-4)。通过广泛的光谱分析(1D-、2D-NMR、HRESIMS、IR、UV)和DP4+分析的NMR计算,阐明了这些新化合物的结构。通过测量它们对LPS刺激的RAW 264.7巨噬细胞中PGE2产生的抑制作用来评估所有分离株的抗炎活性。
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引用次数: 0
A new coumarin glucoside from Angelica pubescens 独活中一个新的香豆素苷。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2275265
Han-tao Zhao , Jun Yang , Qian-feng Chen
A new coumarin glucoside named angelol A-3'-β-D-glucoside and four known compounds (2–5) were isolated from the root of Angelica pubescens. Their chemical structures were elucidated by extensive spectroscopic methods involving HR-ESI-MS, 1D and 2D NMR. The absolute configuration of compound 1 was confirmed by the CD experiment. All compounds were tested for nitric oxide (NO) inhibitory activity in vitro. The results showed that all compounds exhibited weak to moderate inhibition activities of NO production except compound 5.
从独活根中分离得到一个新的香豆素糖苷,命名为angelol A-3'-β-D-糖苷和四个已知化合物(2-5)。通过HR-ESI-MS、1D和2D NMR等广泛的光谱方法阐明了它们的化学结构。通过CD实验证实了化合物1的绝对构型。所有化合物都在体外测试了一氧化氮(NO)的抑制活性。结果表明,除化合物5外,所有化合物均表现出弱至中等的NO生成抑制活性。
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引用次数: 0
Synthesis of 3- and 5-β-anhydroicaritine norcantharidin conjugates 3-和5-β-去斑蝥素偶联物的合成。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2269466
Han Lin , Weiwei Dong , Changkuo Zhao , Xianheng Wang
Using molecular hybridisation to develop conjugates of natural antitumor drugs is one of the research hotspots in recent drug development. In this study, β-anhydroicaritine with anticancer activity was conjugated to norcantharidine selectively to develop new antitumor lead candidates. In the condition of EDCI/DMAP/DCM, the C-3 and C-5 hydroxyl groups of β-anhydroicaritine was coupled with norcantharidin monoacid ester respectively, and the inhibitory activity of the synthesised conjugates against HepG2, MCF-7 and L-02 cells were tested by CCK-8 method. Most of these conjugates showed a better activity against HepG2 and MCF-7 cell lines compared to parent compound icaritin, but weaker than another parent compound norcantharidin.
利用分子杂交技术开发天然抗肿瘤药物缀合物是近年来药物开发的研究热点之一。本研究将具有抗癌活性的β-无氢羊藿碱选择性地与去甲斑蝥啶偶联,以开发新的抗肿瘤先导物。在EDCI/DMAP/DCM条件下,将β-无氢羊藿碱的C-3和C-5羟基分别与去甲斑蝥素单酸酯偶联,采用CCK-8法检测合成的偶联物对HepG2、MCF-7和L-02细胞的抑制活性。这些结合物对HepG2和MCF-7细胞系的抑制活性均优于亲本化合物去斑蝥素,但弱于亲本化合物去斑蝥素。
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引用次数: 0
The genus Palicourea Aubl. (Rubiaceae): source of bioactive compounds.
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2024.2449510
Julio Cesar Maceda Santivañez, Célio Fernando Figueiredo Angolini

The genus Palicourea Aubl. belong to the Rubiaceae family, which is distributed in Tropical America. A compressive bibliographic survey was carried out on the uses in traditional medicine, bioactive properties, and secondary metabolites isolated from the genus. The Web of Science, Science Direct, Pubmed, Scopus and Google Scholar databases were utilised between the years 1990 -2024. The genus is used in traditional medicine for purposes such as antimalarial, haemostatic, dewormer, hypertension, hepatitis, antiulcerogenic, and so on. Bioactivities have been reported for the extracts and isolated compounds such as anti-plasmodial activity, antiprotozoal, antioxidant, anti-inflammatory, antimycobacterial, toxicity, and so on. As well as, anticancer activity, nitric oxide, acetylcholinesterase, and monoamine oxidase inhibitory activity, anthelmintic and others, respectively. Approximately 106 metabolites were isolated from the genus, including iridoids, flavonoids, triterpenes, coumarins, phytosterols, phenolic acids, and alkaloids. The analysis of the collected information shows that the genus is an important source of bioactive compounds. The monoterpene indole alkaloids class represents the largest number of isolated compounds. This review provides a foundation on the phytochemical components, uses in traditional medicine, and biological activities of extracts and isolated compounds of the genus Palicourea Aubl., thereby contributing to future studies in the search for discoveries and potential applications.

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引用次数: 0
Improved naringinase double screen plate assay: progress towards the perfect screening 改进的柚皮苷酶双网板法:朝着完美筛选的方向发展。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2260067
Jitendra D. Salunkhe , Satish V. Patil
Naringinase is an important enzyme for commercial purposes due to its dual activity as both α-l-rhamnosidase and β-d-glucosidase. The traditional method for screening microbes that produce naringinase involves growing them on naringin agar, but this method has limitations and result in false positive results. This is because the growth on the naringin agar plate could be due to the presence of other organisms that produce rhamnosidase or other glucosidases, or those that use agar as a carbon source, rather than actual naringinase producers. To address these limitations, a double screen plate assay was developed using synthetic substrates, to separately test for β-d-glucosidase and α-l-rhamnosidase activity. The presence of a yellow zone of p-nitrophenol indicates the action of these enzymes, and the intensity of the yellow colour zone indicates the potential for naringinase production. This new screening method is a significant improvement in identifying real naringinase producers and represents progress towards a more reliable screening assay.
柚皮苷酶具有α-l-鼠李糖苷酶和β-d-葡萄糖苷酶的双重活性,是一种重要的商业酶。筛选产生柚皮苷酶的微生物的传统方法是在柚皮苷琼脂上培养,但这种方法有局限性,会导致假阳性结果。这是因为柚皮苷琼脂平板上的生长可能是由于存在其他产生鼠李糖苷酶或其他葡糖苷酶的生物,或那些使用琼脂作为碳源的生物,而不是实际的柚皮苷酶生产商。为了解决这些局限性,使用合成底物开发了一种双屏板测定法,分别测试β-d-葡萄糖苷酶和α-l-鼠李糖苷酶的活性。对硝基苯酚黄色区域的存在表明这些酶的作用,黄色区域的强度表明柚皮苷酶产生的潜力。这种新的筛选方法在鉴定真正的柚皮苷酶生产商方面有了重大改进,并代表着在更可靠的筛选方法方面取得了进展。
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引用次数: 0
Design, synthesis and neuroprotective evaluation of nitrogen heterocyclic and triazole derivatives of sarracinic acid 水杨酸氮杂环和三唑衍生物的设计、合成及神经保护作用评价。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2269464
Salman Jameel , Loveleena Kaur , Henna Amin , Showkat Ahmad Bhat , Fayaz A. Malik , Khursheed Ahmad Bhat
Novel sarracinic acid derivatives bearing triazole or N-heterocyclic moiety were prepared via two separate reaction schemes. The triazoles and the N-heterocyclic derivatives were synthesised using standard click chemistry approach and amination of 2-bromoethyl ester of sarracinic acid respectively. All the synthesised derivatives were screened for in vitro neuroprotective activity against corticosterone induced impairment in neuroblastoma cell line SH-SY5Y. Two analogs SA-2 and SA-12 exhibited strong neuroprotective activity. The cell viability, after high dose corticosterone induced cell death, increased remarkably with the pre treatment of SA-2 and SA-12. The in vitro biological activity of SA-2 and SA-12 was verified through docking studies. The docking studies were in good agreement with the biological results. SA-2 and SA-12 showed strong binding affinities with the target protein having ΔGb = −8.88 and −7.52; inhibition constant (ki) = 3.08 nM and 30.9 nM respectively.
通过两种不同的反应方案制备了含有三唑或N-杂环部分的新型沙拉酸衍生物。采用标准点击化学方法和水杨酸2-溴乙酯的胺化反应分别合成了三唑和N-杂环衍生物。筛选所有合成的衍生物对神经母细胞瘤细胞系SH-SY5Y中皮质酮诱导的损伤的体外神经保护活性。两种类似物SA-2和SA-12表现出较强的神经保护活性。高剂量皮质酮诱导细胞死亡后,细胞活力随着SA-2和SA-12的预处理而显著增加。通过对接研究验证了SA-2和SA-12的体外生物学活性。对接研究与生物学结果非常一致。SA-2和SA-12显示出与靶蛋白的强结合亲和力,ΔGb分别为-8.88和-7.52;抑制常数(ki)=3.08 nM和30.9 nM。
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引用次数: 0
Physicochemical investigation and molecular docking analysis of Maha yogaraj Guggulu tablet and virtual screening of its major bioactive compound Maha yogaraj Guggulu片的理化研究和分子对接分析及其主要生物活性化合物的虚拟筛选。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2261071
Sarvesh Sabarathinam , Sanjana Satheesh , Rajappan Chandra Satish Kumar
Guggulsterone plays a significant role in cholesterol-lowering by inhibiting Farnesoid X Receptor. The present study aims to identify the isomers of Guggulsterone with high binding affinity and good binding interaction with targeted protein and positive control atorvastatin. The pharmacokinetic parameters of Guggulsterone isomers were estimated from P.K.C.S.M. online server, and molecular docking analysis was performed from Autodock V.® 4.2.6 Program. From the computer-aided drug designing, we have confirmed that guggulsterone isomers are inhibitors of the CYP3A4 enzyme and hepatotoxic. Guggulsterone isomer showed a stronger binding affinity when compared with atorvastatin. The docking score for Guggulsterone was −9.28 kcal/mol, E-Guggulsterone −9.56 kcal/mol, Z-Guggulsterone −9.79 kcal/mol, M-Guggulsterone −9.45 kcal/mol, and positive control atorvastatin −8.26 kcal/mol. The present study revealed that the isomers of Guggulsterone have high binding affinity and good binding interaction with targeted proteins.
Guggulsterone通过抑制Farnesoid X受体在降低胆固醇方面发挥重要作用。本研究旨在鉴定Guggulsterone与靶蛋白和阳性对照阿托伐他汀具有高结合亲和力和良好结合相互作用的异构体。Guggulsterone异构体的药代动力学参数由P.K.C.S.M.在线服务器估计,分子对接分析由Autodock V.®4.2.6程序进行。通过计算机辅助药物设计,我们已经证实了古龙甾酮异构体是CYP3A4酶的抑制剂和肝毒性。Guggulsterone异构体与阿托伐他汀相比显示出更强的结合亲和力。Guggulsterone的对接得分为-9.28 kcal/mol,E-Guggulsterone-9.56 kcal/mol,Z-Guggulsterone-9.79 kcal/mol,M-Guggulsterone-9.45 kcal/mol,阳性对照阿托伐他汀-8.26 kcal/mol。本研究表明,Guggulsterone的异构体具有较高的结合亲和力和与靶蛋白的良好结合相互作用。
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引用次数: 0
Two new flavanones from Polytrichum commune Hedw 两个新的黄烷酮从Polytrichum公社Hedw。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2272030
Hao Cheng , Yan-Lei Su , Meng-Tong Liu , Shi-Nong Yuan , Shao-Nan Wang , Fang-Jie Hou , Ma Dong-Lai , Duan Xu-Hong
Seven flavanones, including two new compounds coupled with styryl units, communins C (1) and D (2), as well as five known compounds, were isolated from Polytrichum commune Hedw. The planar structures of all compounds were determined using extensive spectroscopic analysis. The absolute configurations of two new compounds were assigned by comparing experimental ECD with calculated ECD. The cytotoxicity of all isolates against HCT-116, BGC803, MCF7 and PANC-1 cell lines was evaluated. Communin D exhibited significant cytotoxic activity on BGC803 cells with an IC50 value of 9.3 μM.
从Polytrichum community Hedw中分离到7种黄烷酮,包括两种与苯乙烯单元偶联的新化合物,公报子C(1)和D(2),以及5种已知化合物。使用广泛的光谱分析确定了所有化合物的平面结构。通过比较实验ECD和计算ECD,确定了两种新化合物的绝对构型。评价了所有分离株对HCT-116、BGC803、MCF7和PANC-1细胞系的细胞毒性。Communin D对BGC803细胞表现出显著的细胞毒性活性,IC50值为9.3 μM。
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引用次数: 0
Experimental studies on thermal and FTIR characterisation of bio-degradable neat neem gum and epoxy resin for composite material applications 用于复合材料应用的可生物降解纯印楝胶和环氧树脂的热特性和FTIR特性的实验研究。
IF 1.9 3区 化学 Q3 CHEMISTRY, APPLIED Pub Date : 2025-02-01 DOI: 10.1080/14786419.2023.2275266
G. Sundarapandian , Arunachalam K
This article aims to assess the suitability of natural neem gum in various composite material applications in place of epoxy resin. The assessment was done by thermal characterisation, experimental study and comparative analysis of thermal behaviour, Fourier transform IR spectroscopy (FTIR) characterisation and comparison of functional groups and mechanical properties of neat epoxy and neat neem resins. To study and compare thermal behaviour differential scanning calorimetry (DSC), thermogravimetric (TG) and relative derivative TG (DTG) analysis were conducted. The glass transition temperatures, exothermic and endothermic peaks, curing of thermosetting epoxy and crystallisation of polymeric neem, value of % cure and mass change or mass loss concerning temperature of both the resins were experimentally determined and comparative analysis was conducted to find the suitability of neem resin in composite material applications in place of epoxy resin. Functional groups of neem gum were identified and mechanical properties such as bond strength, toughness, rigidity and ductility were characterised and compared with that of epoxy resin by conducting FTIR.
本文旨在评估天然印楝胶代替环氧树脂在各种复合材料应用中的适用性。通过热表征、热行为的实验研究和比较分析、傅立叶变换红外光谱(FTIR)表征以及纯环氧树脂和纯neem树脂的官能团和机械性能的比较来进行评估。为了研究和比较热行为,进行了差示扫描量热法(DSC)、热重分析(TG)和相对导数TG分析(DTG)。通过实验确定了玻璃化转变温度、放热和吸热峰、热固性环氧树脂的固化和聚合物neem的结晶、%固化值以及与温度有关的质量变化或质量损失,并进行了比较分析,以发现neem树脂代替环氧树脂在复合材料应用中的适用性。通过红外光谱对印楝胶的官能团进行了鉴定,并对其粘结强度、韧性、刚度和延展性等力学性能进行了表征,并与环氧树脂进行了比较。
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引用次数: 0
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Natural Product Research
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