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New imidazolidindionedioximes and their Pt(II) complexes: synthesis and investigation of their antitumoral activities on breast cancer cells. 新型咪唑烷吲哚二氧肟及其铂(II)配合物:合成及其对乳腺癌细胞抗肿瘤活性的研究。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-22 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3681
Emrah Karahan, Tuğba Gençoğlu Katmerlikaya, Emel Önal, Aydan Dağ, Ayşe Gül Gürek, Vefa Ahsen

Breast cancer is one of the most common types of cancer worldwide and has the most lethality ratio for females among all cancers. Although current cancer therapeutics have made considerable advancements, there is still room for improvement in terms of efficacy. Many anticancer drugs have a risk of causing serious adverse effects due to their nonspecific cytotoxic effects on both tumor and healthy cells. New therapeutics might have a greater ability to kill cancer cells, reduce the volume of tumors, and improve overall therapy response rates. Herein, we report the efficient synthesis and characterization of three amphi vic-dioximes and their six novel mono-, which are extremely rare in platinum chemistry, and bisplatinum(II) complexes for breast cancer treatment. Antitumoral activities of Pt(II) complexes have been investigated on CCD-1079Sk healthy fibroblast cell line, MCF-7 and MDA-MB-231 human breast cancer cell lines. Cytotoxicity, cell cycle, and apoptotic assays were performed. All new Pt(II) complexes exhibited selective antiproliferative effects on breast cancer cells by showing less cytotoxicity to healthy cells than known anticancer drugs cisplatin and bicalutamide. In vitro studies show that these new Pt complexes have high anticancer and antiproliferative effects and may be new alternatives to existing anticancer drugs.

乳腺癌是全球最常见的癌症之一,也是女性致死率最高的癌症。尽管目前的癌症疗法已经取得了长足的进步,但在疗效方面仍有改进的余地。许多抗癌药物由于对肿瘤细胞和健康细胞具有非特异性细胞毒性作用,有可能导致严重的不良反应。新疗法可能具有更强的杀灭癌细胞、缩小肿瘤体积和提高总体治疗反应率的能力。在此,我们报告了用于乳腺癌治疗的三种双沧海二氧肟及其六种新型单铂和双铂(II)配合物的高效合成和表征。在 CCD-1079Sk 健康成纤维细胞系、MCF-7 和 MDA-MB-231 人类乳腺癌细胞系上研究了铂(II)配合物的抗肿瘤活性。实验中进行了细胞毒性、细胞周期和细胞凋亡检测。与已知的抗癌药物顺铂和比卡鲁胺相比,所有新的铂(II)复合物对健康细胞的细胞毒性较低,对乳腺癌细胞具有选择性抗增殖作用。体外研究表明,这些新型铂配合物具有很强的抗癌和抗增殖作用,可能成为现有抗癌药物的新替代品。
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引用次数: 0
Investigation of benzoic acid and sorbic acid concentrations in tomato paste, pepper paste, ketchup, mayonnaise, and barbeque sauce samples by headspace gas chromatography-mass spectrometry. 利用顶空气相色谱-质谱法研究番茄酱、辣椒酱、番茄酱、蛋黄酱和烧烤酱样品中的苯甲酸和山梨酸浓度。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-22 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3663
Orhan Destanoğlu

In this study, it was aimed at investigating benzoic acid (BA) and sorbic acid (SoA) concentrations in tomato paste, pepper paste, ketchup, mayonnaise, and barbeque sauce samples by a validated static headspace gas chromatography-mass spectrometry (GC-MS) method. Salicylic acid (SalA) was used as internal standard and the measurements were conducted in the wide linear concentration ranges of BA and SoA which were 2.5-5000 and 12.5-5000, respectively. The limit of detections (LODs) were determined to be 1.5 and 4.5 mg/kg while the limit of quantifications (LOQs) were 2.5 and 12.5 mg/kg for BA and SoA, respectively. The average recovery% values of BA and SoA were found to be 98.5% and 98.7% in an open tomato paste sample while these values were 98.7% and 100.3% in a mayonnaise sample, respectively. Accuracy of the proposed method was confirmed by statistically (significance test) evaluating excellent recovery values. In real samples, while the results of the canned tomato pastes and industrial sauce samples were found suitable, BA and SoA ​​were determined in some tomato and pepper paste products sold under the traditional or homemade name although use of the preservatives in the pastes were prohibited. It is vital for public health to prevent adulteration in pastes which is indispensable for Turkish cuisine as well as prevalently consumed in the world. Therefore, the proposed method can be used in food control laboratories due to its reliability and consumption of much less toxic chemical reagents.

本研究采用经过验证的静态顶空气相色谱-质谱法(GC-MS),对番茄酱、辣椒酱、番茄酱、蛋黄酱和烧烤酱样品中的苯甲酸(BA)和山梨酸(SoA)浓度进行了调查。以水杨酸(SalA)为内标,在 BA 和 SoA 分别为 2.5-5000 和 12.5-5000 的宽线性浓度范围内进行测定。BA 和 SoA 的检出限(LOD)分别为 1.5 和 4.5 mg/kg,定量限(LOQ)分别为 2.5 和 12.5 mg/kg。在开放的番茄酱样品中,BA 和 SoA 的平均回收率分别为 98.5% 和 98.7%;在蛋黄酱样品中,这两个值分别为 98.7% 和 100.3%。通过统计(显著性检验)评估出色的回收率,证实了所建议方法的准确性。在实际样品中,虽然罐装番茄酱和工业调味酱样品的结果合适,但在一些以传统或自制名称出售的番茄酱和辣椒酱产品中检测到了 BA 和 SoA,尽管这些番茄酱中禁止使用防腐剂。糊状食品是土耳其美食中不可或缺的,也是世界上普遍消费的食品,防止糊状食品掺假对公共卫生至关重要。因此,建议的方法由于其可靠性和使用毒性更低的化学试剂,可用于食品控制实验室。
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引用次数: 0
Phosphorus and nitrogen-containing soybean oil polyols: Effect on the mechanical properties and flame retardancy of polyurethane foam. 含磷和氮的大豆油多元醇:对聚氨酯泡沫机械性能和阻燃性的影响。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-22 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3656
Deniz Öztaşkin, Lütfullah Yusuf Yivlik, İlayda Acaroğlu Degitz, Tarık Eren

In recent years, there has been an increasing interest in producing new materials that use renewable resources and halogen-free flame retardants with nonleaching properties. This research focuses on designing and synthesizing phosphorus-nitrogen-based biopolyols for use in polyurethane (PU) foam production. Polyol (ESBO-DYM) with dual functionalities, renewability, and nonflammability is synthesized through the epoxy ring-opening reaction of epoxidized soybean oil with phosphorus and nitrogen-containing tetraol products (DYM). The mechanical and flame retardant properties of PU foams with the addition of an ESBO-DYM were investigated. Increasing the amount of phosphorus in the PU foams increased the thermal stability properties. Using 100% ESBO-DYM as a polyol in the foam formulation increased the limiting oxygen index (LOI) value to 22.9% and resulted in the highest char yield according to the thermal gravimetric analysis (17% at 600 °C). Additionally, the introduction of ESBO-DYM polyol into the formulation resulted in a decrease in the compression strength of the foams. The foam density decreased as the amount of ESBO-DYM polyol in the formulation increased. The foam with the highest amount of ESBO-DYM had a foam density of 29.1 kg/m3. The morphology of the foams was characterized using a scanning electron microscope (SEM). As a result of this study, flame retardant polyurethane foams were formulated using a renewable source, polyol, along with commercial compounds.

近年来,人们对生产使用可再生资源和无卤素阻燃剂且具有非沥滤特性的新材料越来越感兴趣。本研究的重点是设计和合成用于聚氨酯泡沫生产的磷氮基生物多元醇。通过环氧化大豆油与含磷和氮的四元醇产品(DYM)的环氧开环反应,合成了具有双重功能性、可再生性和不可燃性的多元醇(ESBO-DYM)。研究了添加 ESBO-DYM 的聚氨酯泡沫的机械和阻燃性能。增加聚氨酯泡沫中的磷含量可提高热稳定性。在泡沫配方中使用 100% ESBO-DYM 作为多元醇,可将极限氧指数(LOI)值提高到 22.9%,并且根据热重分析,可获得最高的炭产量(600 °C 时为 17%)。此外,在配方中引入 ESBO-DYM 多元醇会降低泡沫的压缩强度。泡沫密度随着配方中 ESBO-DYM 多元醇用量的增加而降低。ESBO-DYM 含量最高的泡沫密度为 29.1 公斤/立方米。使用扫描电子显微镜(SEM)对泡沫的形态进行了表征。这项研究的结果是,使用可再生资源多元醇和商用化合物配制出了阻燃聚氨酯泡沫。
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引用次数: 0
Copolymerization of pyrrole and carbazole onto polyester textile. 将吡咯和咔唑共聚到聚酯织物上。
IF 1.4 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-18 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3644
Mehmet Akif Küçükkaya, Utku Ustamehmetoğlu, Esma Sezer, Belkıs Ustamehmetoğlu

The purpose of this study was the polymerization of carbazole (Cz), pyrrole (Py) and copolymerization of them onto polyester (PES) textile with chemical oxidative method by using FeCl3. First, in order to determine the optimum conditions, the effect of polymerization steps, the immersion order of the PES to the oxidant and monomer solutions, time, monomer, oxidant, and surfactant concentrations and types on the conductivities of PES/PCz composite were investigated and at this conditions, conductive composite, PES/P[Py-co-Cz] was obtained. The highest conductivities were obtained as 12.4 mS/cm and 9.0 mS/cm for PES/PCz and PES/P[Py-co-Cz], respectively. Further characterization of PES/P[Py-co-Cz] was performed by conductivity, FTIR, scanning electron microscopy (SEM), and dynamic mechanical analysis (DMA) measurements, and results were compared with PES/PCz and also PES/PPy. The presence of Py and Cz in the same polymer chain created synergy and improved the conductivity and mechanical properties of the composite.

本研究的目的是采用化学氧化法,利用 FeCl3 将咔唑(Cz)、吡咯(Py)及其共聚物聚合到聚酯(PES)纺织品上。首先,为了确定最佳条件,研究了聚合步骤、PES 对氧化剂和单体溶液的浸入顺序、时间、单体、氧化剂和表面活性剂的浓度和类型对 PES/PCz 复合材料电导率的影响,并在此条件下获得了导电复合材料 PES/P[Py-co-Cz]。PES/PCz 和 PES/P[Py-co-Cz]的最高电导率分别为 12.4 mS/cm 和 9.0 mS/cm。通过电导率、傅立叶变换红外光谱(FTIR)、扫描电子显微镜(SEM)和动态机械分析(DMA)测量对 PES/P[Py-co-Cz]进行了进一步表征,并将结果与 PES/PCz 和 PES/PPy 进行了比较。在同一条聚合物链中含有 Py 和 Cz 产生了协同作用,提高了复合材料的导电性和机械性能。
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引用次数: 0
Development of a new nanosensor for the determination of food coloring Sunset Yellow in powder drinks using L-cysteine coated copper nanoclusters. 利用包覆 L-半胱氨酸的纳米铜簇开发一种新型纳米传感器,用于测定粉末饮料中的食用色素日落黄。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-18 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3654
Mehmetcan Bilkay, Büşra Karataş, Hayriye Eda Şatana Kara

Sunset Yellow (SY), which is an artificial azo dye, is preferable for its high stability and low cost. The determination of SY in foods is extremely important for human health because excessive consumption of SY has harmful effects, such as hyperactivity disorder and cancer. In this method, L-cysteine coated copper nanoclusters (CuNCs) were used as a fluorescence probe. L-cysteine has been used as both a reducing and stabilizing agent. One-step green hydrothermal synthesis of CuNCs was made. L-cysteine-coated CuNCs have been characterized using several of methods. CuNCs quenching mechanism is static and inner filter effect (IFE). The linear range is 0.65-14 μg.ml-1 at optimum conditions. LOD and LOQ values were calculated as 0.1 and 0.35 μg.ml-1, respectively. The proposed method was used for the determination of SY in different type of powder drinks. The developed nanosensor is environmentally friendly, easy, fast, reproducible, and low cost.

日落黄(SY)是一种人工偶氮染料,因其稳定性高、成本低而备受青睐。由于摄入过量的日落黄会对人体产生有害影响,如多动障碍和癌症,因此测定食品中的日落黄对人体健康极为重要。在该方法中,L-半胱氨酸包被的纳米铜簇(CuNCs)被用作荧光探针。L-半胱氨酸既可用作还原剂,也可用作稳定剂。一步绿色水热法合成了 CuNCs。使用多种方法对 L-半胱氨酸包覆的 CuNCs 进行了表征。CuNCs 的淬火机制是静态和内部过滤效应(IFE)。在最佳条件下,其线性范围为 0.65-14 μg.ml-1。计算得出的 LOD 和 LOQ 值分别为 0.1 和 0.35 μg.ml-1。该方法可用于测定不同类型粉末饮料中的 SY。所开发的纳米传感器具有环保、简便、快速、重现性好、成本低等优点。
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引用次数: 0
Senggani fruit (Melastoma malabathricum Linn.) extract as a natural indicator in pH-responsive PVA-taro starch plastic packaging. 将森加尼果(Melastoma malabathricum Linn.)提取物作为 pH 响应型 PVA-芋头淀粉塑料包装中的天然指示剂。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-15 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3672
Rika Risma Dewi, Intan Syahbanu, Winda Rahmalia

Polyvinyl alcohol (PVA)-starch-based bioplastics are widely used in many applications. pH-responsive plastic packaging was produced through the incorporation of senggani (Melastoma malabathricum Linn.) fruit extract into PVA-taro starch-based plastic packaging. The objective of this research was to examine the characteristics of senggani fruit extract under different pH conditions and explore its application as a pH indicator in intelligent packaging. The senggani fruit was extracted through the maceration method using a solvent comprising 96% ethanol and 3% citric acid, with a ratio of 85:15 (v/v). The senggani fruit extract solution underwent color changes, appearing pink at pH levels below 6, pale purple at pH 7-11, and brownish-yellow at pH 12-14. Notably, the color of the senggani fruit extract solution remained stable at pH < 5. Before the addition of the senggani fruit extract, the PVA-taro starch solution produced a brownish-yellow plastic packaging. However, following the addition of senggani fruit extract, the plastic packaging turned pink. The addition of senggani fruit extract affected the mechanical properties of plastic packaging, resulting in a reduction in swelling from 103.679 ± 2.456% to 57.827 ± 3.563%, a decrease in tensile strength value from 3.827 ± 0.603 Mpa to 1.991 ± 0.460 Mpa, and a decline in the percent elongation value from 156.250 ± 12.392% to 116 ± 6.722%. Plastic packaging incorporating senggani fruit extract exhibits color changes across the pH range of 1-14, accompanied by varying color parameter values (L, a, b, E, and WI). Therefore, it has the potential to be used as intelligent packaging for monitoring food freshness and quality.

聚乙烯醇(PVA)-淀粉基生物塑料被广泛应用于许多领域。 通过在 PVA-芋头淀粉基塑料包装中加入森加尼(Melastoma malabathricum Linn.)果实提取物,生产出了 pH 响应塑料包装。本研究的目的是检测人参果提取物在不同 pH 值条件下的特性,并探索其作为 pH 值指示剂在智能包装中的应用。采用浸渍法提取人参果,溶剂包括 96% 的乙醇和 3% 的柠檬酸,两者的比例为 85:15(v/v)。人参果提取物溶液的颜色发生了变化,pH 值低于 6 时呈粉红色,pH 值为 7-11 时呈浅紫色,pH 值为 12-14 时呈棕黄色。值得注意的是,在 pH 值小于 5 时,人参果提取物溶液的颜色保持稳定。在添加人参果提取物之前,PVA-芋头淀粉溶液产生的塑料包装呈棕黄色。然而,在添加了森加尼果提取物后,塑料包装变成了粉红色。添加人参果提取物影响了塑料包装的机械性能,使膨胀率从 103.679 ± 2.456% 降至 57.827 ± 3.563%,拉伸强度值从 3.827 ± 0.603 Mpa 降至 1.991 ± 0.460 Mpa,伸长率从 156.250 ± 12.392% 降至 116 ± 6.722%。添加了红桑果提取物的塑料包装在 pH 值为 1-14 的范围内呈现出颜色变化,并伴随着不同的颜色参数值(L、a、b、E 和 WI)。因此,它有可能被用作监测食品新鲜度和质量的智能包装。
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引用次数: 0
Design and characterization of phosphonic acid-functionalized grafted sepiolite nanohybrids and their adsorption studies for removal of copper ions from aqueous solution. 膦酸官能化接枝海泡石纳米杂质的设计与表征及其用于去除水溶液中铜离子的吸附研究。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-09 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3674
Mehwish Tahir, Asıf Raza, Amara Nasir, Tariq Yasin, Shamila Imtiaz

In this study, we synthesized novel, economically efficient phosphonic acid-functionalized grafted sepiolite nanohybrids for selective elimination of copper ions from water. These nanohybrids were prepared by graft polymerization of glycidyl methacrylate onto sepiolite. We utilized free radical graft polymerization to graft glycidyl methacrylate (GMA) onto silanized sepiolite. The nanohybrids obtained exhibited a grafting percentage of 479% at 0.3 g of KPS initiator, 15% GMA monomer, and after 4 h of reaction. In pursuit of selectively removing metal ions from water, the nanohybrid with the highest grafting (PGE3) was chemically treated with phosphoric acid to introduce phosphonic acid groups on it. FTIR, XRD, SEM, CHO analysis, BET, and TGA analysis were utilized to characterize the developed nanohybrids. Batch adsorption studies were carried out using AAS process, examining the impact of pH, adsorbent weight, contact time, adsorbate concentration, and temperature on the adsorption process. Due to the selectivity of phosphonic acid groups towards copper ions, phosphonic acid-functionalized grafted sepiolite nanohybrid (PGE3-P) was used for copper ions removal from its aqueous solution. The maximum adsorption capacity of PGE3-P adsorbents was 134.5 mg/g for copper ions. The data from kinetic studies suggests that the adsorption process of copper ions followed a pseudosecond-order model. Furthermore, Langmuir isotherm proved to be a more fitting model in equilibrium isothermal investigations. The thermodynamic analysis of the data indicates that the adsorption of copper ions by PGE3-P is an endothermic and spontaneous process. The development of this phosphonic acid-functionalized grafted sepiolite nanohybrid adsorbent is a new contribution into the field of adsorption. The developed material can be utilized as selective adsorbent for elimination of other heavy metals from water.

在这项研究中,我们合成了新型、经济高效的膦酸官能化接枝海泡石纳米杂化物,用于选择性去除水中的铜离子。这些纳米杂质是通过甲基丙烯酸缩水甘油酯与海泡石的接枝聚合制备的。我们利用自由基接枝聚合法将甲基丙烯酸缩水甘油酯(GMA)接枝到硅烷化的海泡石上。在 0.3 克 KPS 起始剂、15% GMA 单体和 4 小时反应后,获得的纳米混合物的接枝率达到 479%。为了选择性地去除水中的金属离子,用磷酸对接枝率最高的纳米杂化物(PGE3)进行了化学处理,在其上引入了膦酸基团。利用傅立叶变换红外光谱、X 射线衍射、扫描电镜、CHO 分析、BET 和 TGA 分析来表征所开发的纳米杂化物。利用 AAS 工艺进行了批量吸附研究,考察了 pH 值、吸附剂重量、接触时间、吸附剂浓度和温度对吸附过程的影响。由于膦酸基团对铜离子具有选择性,因此采用了膦酸官能化接枝海泡石纳米杂化物(PGE3-P)来去除水溶液中的铜离子。PGE3-P 吸附剂对铜离子的最大吸附容量为 134.5 mg/g。动力学研究数据表明,铜离子的吸附过程遵循假秒序模型。此外,在平衡等温研究中,朗缪尔等温线被证明是一个更合适的模型。数据的热力学分析表明,PGE3-P 对铜离子的吸附是一个自发的内热过程。这种膦酸官能化接枝海泡石纳米杂化吸附剂的开发是对吸附领域的一个新贡献。所开发的材料可用作去除水中其他重金属的选择性吸附剂。
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引用次数: 0
Performance test of Zn-astaxanthin complex-sensitized solar cell: effect of light intensity on open-circuit voltage and short-circuit current values. Zn-astaxanthin 复合物敏化太阳能电池的性能测试:光照强度对开路电压和短路电流值的影响。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-05 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3653
Septiani Septiani, Winda Rahmalia, Thamrin Usman

The sensitizer is one of the most essential dye-sensitized solar cell (DSSC) components. In the present research, a Zn-astaxanthin complex was investigated as a sensitizer, compared to pure astaxanthin. The complex with a 1:1 mole ratio between astaxanthin and Zn2+ was synthesized in a reflux reactor at 37-60 °C. The product was analyzed using Proton Nuclear Resonance (1H-NMR), which indicates the presence of chelate formation between Zn2+ with two atoms of oxygen on the terminal cyclohexane ring of astaxanthin. The interaction of sensitizers (astaxanthin and Zn-astaxanthin) on the photoelectrode surface in this study was analyzed using a Fourier Transform Infra-Red (FTIR) and Ultraviolet-Visible Diffuse Reflectance Spectroscopy (UV-Vis DRS). The FTIR spectra of photoelectrode immersed in Zn-astaxanthin show peaks of C=O stretching and vibration -OH group at 1730 and 1273 cm-1, respectively, and H-C-H stretching vibration with high intensity in 2939, 2923, and 2853 cm-1. The UV-Vis DRS analysis shows the band gap of photoelectrode (PE), photoelectrode immersed in astaxanthin (PE/astaxanthin), and Zn-astaxanthin (PE/Zn-astaxanthin) are 3.19, 1.65, and 1.59 eV, respectively. Under illumination intensity of 300 W/m2, the maximum energy conversion efficiency of DSSC with Zn-astaxanthin as sensitizer is (0.03 ± 0.0022)%, higher than DSSC with astaxanthin as sensitizer ((0.12 ± 0.0052)%). Up to 70 h of illumination, DSSC with Zn-astaxanthin as a sensitizer also has better stability than astaxanthin-based DSSC.

敏化剂是染料敏化太阳能电池(DSSC)最基本的组成部分之一。与纯虾青素相比,本研究将 Zn- 虾青素复合物作为敏化剂进行了研究。虾青素和 Zn2+ 的摩尔比为 1:1,在 37-60 °C 的回流反应器中合成。利用质子核共振(1H-NMR)对产物进行了分析,结果表明 Zn2+ 与虾青素末端环己烷环上的两个氧原子形成了螯合物。本研究使用傅立叶变换红外光谱(FTIR)和紫外-可见漫反射光谱(UV-Vis DRS)分析了敏化剂(虾青素和 Zn-虾青素)与光电极表面的相互作用。浸泡在 Zn-astaxanthin 中的光电极的傅立叶变换红外光谱显示,在 1730 和 1273 cm-1 处分别有 C=O 伸展振动和 -OH 基团振动峰,在 2939、2923 和 2853 cm-1 处有强度较高的 H-C-H 伸展振动峰。紫外-可见DRS分析表明,光电极(PE)、浸入虾青素的光电极(PE/虾青素)和Zn-虾青素(PE/Zn-虾青素)的带隙分别为3.19、1.65和1.59 eV。在光照强度为 300 W/m2 的条件下,以 Zn-astaxanthin 为敏化剂的 DSSC 的最大能量转换效率为 (0.03 ± 0.0022)%,高于以虾青素为敏化剂的 DSSC((0.12 ± 0.0052)%)。与虾青素基 DSSC 相比,以 Zn-astaxanthin 为敏化剂的 DSSC 在长达 70 小时的光照下也具有更好的稳定性。
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引用次数: 0
Computational drug repurposing effort for identifying novel hits for the treatment of diseases such as endometriosis, uterine fibroids, and prostate cancer. 计算药物再利用工作,以确定治疗子宫内膜异位症、子宫肌瘤和前列腺癌等疾病的新药。
IF 1.3 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-04 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3667
Ahmet Buğra Ortaakarsu, Hilal Medetalibeyoğlu

This research aimed to identify potential drug compounds from the ZINC15 molecule database that could effectively treat GnRH1R-related diseases. The study utilized molecular docking and molecular dynamics methods to achieve this goal, which is crucial in drug repurposing research. The virtual screening process involved analyzing known drug compounds using molecular docking. Additionally, molecular dynamics simulations and MM-GBSA were employed to evaluate the stability of the complexes and determine the interactions between the compounds and protein structure. As a result, this study provides significant insights for treating diseases such as endometriosis, uterine fibroids, and prostate cancer related to GnRH1R. The study also involved designing new drugs and identifying necessary molecular scaffolds.

这项研究旨在从ZINC15分子数据库中找出能有效治疗GnRH1R相关疾病的潜在药物化合物。该研究利用分子对接和分子动力学方法来实现这一目标,这在药物再利用研究中至关重要。虚拟筛选过程包括利用分子对接分析已知药物化合物。此外,还采用了分子动力学模拟和 MM-GBSA 来评估复合物的稳定性,并确定化合物与蛋白质结构之间的相互作用。因此,这项研究为治疗与 GnRH1R 有关的子宫内膜异位症、子宫肌瘤和前列腺癌等疾病提供了重要启示。这项研究还涉及设计新药物和确定必要的分子支架。
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引用次数: 0
Palladium (0) nanoparticles distributed on lanthanum (III) oxide as an effective catalyst for the methanolysis of hydrazine-borane to produce hydrogen. 分布在氧化镧(III)上的钯(0)纳米粒子是肼硼烷甲醇化制氢的有效催化剂。
IF 1.4 4区 化学 Q3 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-01-03 eCollection Date: 2024-01-01 DOI: 10.55730/1300-0527.3646
Adem Rüzgar, Lokman Şener, Yaşar Karataş, Mehmet Gülcan

Pd (0) nanoparticles (NPs) distributed on lanthanum (III) oxide were ex situ generated from the reduction of Pd2+ ions using NaBH4 as reducing agent. The Pd/La2O3 displayed good catalytic activity in H2(g) releasing from the hydrazine-borane (HB) methanolysis reaction and it was identified by advanced techniques. Pd/La2O3 was found to be an active catalyst procuring three equiv. H2(g) per mole of HB. The results from TEM images represent the formation of Pd (0) NPs with an average particle size of 1.94 ± 0.1 nm on the surface of La2O3. Moreover, Pd/La2O3 with various Pd loadings were prepared and tested as catalyst in the methanolysis reaction to find the optimum metal loading on La2O3 support. The highest H2 formation rate was achieved with 3.0 wt% Pd. Pd/La2O3 catalyst exhibited a turnover frequency (TOF) value of 24.4 mol H2 mol Pd-1 min-1 in the reaction conditions. Additionally, the effect of different catalyst concentrations and temperatures on the reaction kinetics for the methanolysis of HB catalyzed by Pd/La2O3.

以 NaBH4 为还原剂,通过还原 Pd2+ 离子,在氧化镧 (III) 上原位生成了分布在氧化镧 (III) 上的 Pd (0) 纳米粒子 (NPs)。Pd/La2O3 在肼-硼烷(HB)甲醇分解反应中释放 H2(g) 的过程中表现出良好的催化活性,并通过先进技术对其进行了鉴定。研究发现,Pd/La2O3 是一种活性催化剂,每摩尔 HB 可产生三当量 H2(g)。TEM 图像结果表明,在 La2O3 表面形成了平均粒径为 1.94 ± 0.1 nm 的 Pd (0) NPs。此外,制备并测试了不同钯负载量的 Pd/La2O3 作为甲醇分解反应的催化剂,以找出 La2O3 载体上的最佳金属负载量。3.0 wt% Pd 的 H2 生成率最高。在反应条件下,Pd/La2O3 催化剂的翻转频率 (TOF) 值为 24.4 mol H2 mol Pd-1 min-1。此外,不同催化剂浓度和温度对 Pd/La2O3 催化 HB 甲烷化反应动力学的影响也不同。
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Turkish Journal of Chemistry
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