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Fabrication of copper ion-substituted hydroxyapatite/Silk fiber/Methylcellulose composite: mechanical, antimicrobial, hemocompatibility, bioactivity and cytocompatibility evaluation 制造铜离子取代的羟基磷灰石/蚕丝纤维/甲基纤维素复合材料:机械、抗菌、血液相容性、生物活性和细胞相容性评估
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-10 DOI: 10.1016/j.rechem.2024.101851
Valarmathi N, Sumathi Shanmugam
Herein, we reported the preparation of copper substituted hydroxyapatite (Cu-HAP) and fabrication of electrospun composites using Cu-HAP, SF (Silk fiber) and MC (Methylcellulose) by E-Spin method. Characterization techniques such as XRD (phase formation), FTIR (chemical bonds), SEM and EDAX (surface morphology and elemental composition) were carried out. Porosity measurement, swelling and mechanical properties were carried out to investigate the physicochemical properties of the fabricated electrospun composites. The hemocompatibility analysis indicated a hemolysis ratio < 2 %, which confirms the blood compatibility nature of the composite. Antibacterial activity of Copper hydroxyapatite/silk fiber/ Methylcellulose electrospun composite showed estimable activity against E.coli (zone of inhibition: 46 ± 0.94 mm) compared with pure SF/MC electrospun composite (33 ± 1.21). Bioactivity study confirmed the development of bone-like apatite on the surfaces of optimized (SF/MC 30 wt% of Cu-HAP) electrospun composite. Furthermore, MG63 cells were utilised to study the biocompatibility of the enhanced electrospun composite and good cell viability (99.93 ± 0.12 % using 25 μg/mL) was observed from microscopic image and the results showed that 30 wt% of Cu-HAP added polymer composite has outstanding osteoinductivity, biocompatibility, and antibacterial results, making it a very valuable aspirant for use in bone tissue engineering (BTE) applications to repair bone defects.
在此,我们报道了铜取代羟基磷灰石(Cu-HAP)的制备,以及使用 Cu-HAP、SF(丝纤维)和 MC(甲基纤维素)通过 E-Spin 法制造电纺复合材料。表征技术包括 XRD(相形成)、FTIR(化学键)、SEM 和 EDAX(表面形态和元素组成)。为了研究电纺复合材料的物理化学特性,还进行了孔隙度测量、溶胀和机械特性研究。血液相容性分析表明溶血率为 2%,这证实了复合材料的血液相容性。与纯 SF/MC 电纺复合材料(33 ± 1.21)相比,羟基磷灰石铜/蚕丝纤维/甲基纤维素电纺复合材料对大肠杆菌的抗菌活性(抑菌区:46 ± 0.94 mm)可估计。生物活性研究证实,优化的(SF/MC 30 wt% Cu-HAP)电纺复合材料表面形成了类骨磷灰石。此外,还利用 MG63 细胞研究了增强型电纺复合材料的生物相容性,从显微镜图像中观察到良好的细胞存活率(使用 25 μg/mL 时为 99.93 ± 0.12 %),结果表明,添加 30 wt% Cu-HAP 的聚合物复合材料具有出色的骨诱导性、生物相容性和抗菌效果,使其成为骨组织工程(BTE)应用中修复骨缺损的非常有价值的材料。
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引用次数: 0
Synthesis, confirmation based on in vitro and in silico study of thiadiazole-based thiazolidinone scaffolds: An approach toward Covid-19 基于体外和硅学研究的噻二唑基噻唑烷酮支架的合成和确认:研究 Covid-19 的一种方法
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-10 DOI: 10.1016/j.rechem.2024.101845
Shoaib Khan , Rafaqat Hussain , Yousaf Khan , Tayyiaba Iqbal , Mohammad Shahidul Islam , Tahani Mazyad Almutairi
Coronavirus disease (COVID-19), an infectious disease caused by a newly discovered Coronavirus (severe acute respiratory syndrome coronavirus-2 (SARS-CoV-2) was targeted in the current research study. Different hybrid thiadiazole based thiazolidinone derivatives were designed and successfully synthesized. Structural validation of novel compounds was achieved via spectroscopy by employing 1HNMR, 13CNMR, HREI-MS. All the synthesized compounds were biologically evaluated to study their potential to inhibit the main protease of SARS-CoV-2. The SAR data revealed that among the synthesized thiadiazole-based thiazolidinone derivatives showed significant inhibitory profile against the targeted enzymes. Different substituted compounds 1 (IC50 = 0.10 µM), 2 (IC50 = 1.43 µM), 4 (IC50 = 2.25 µM), 5 (IC50 = 24.56 µM), 6 (IC50 = 26.47 µM), and 8 (IC50 = 19.59 µM), were found with excellent potentials, even more potent than its standard GC-376 drug (IC50 = 0.439 µM). Among the potent candidates of the series, compound 1 bearing CF3 at meta and NO2 at ortho position exhibited the top ranking potential and emerged as the excellent inhibitor of protease of SARS-CoV-2. Furthermore, these potent analogues were subjected to molecular docking study in order to explore their bonding interactions with active sites of SARS-CoV-2 3CL protease. This study was also enriched with ADME analysis to evaluate drug-likeness of lead compounds of the series.
冠状病毒病(COVID-19)是一种由新发现的冠状病毒(严重急性呼吸系统综合征冠状病毒-2(SARS-CoV-2))引起的传染病。研究人员设计并成功合成了不同的基于噻二唑的混合噻唑烷酮衍生物。通过使用 1HNMR、13CNMR 和 HREI-MS 进行光谱分析,对新型化合物进行了结构验证。对所有合成的化合物进行了生物学评价,以研究它们抑制 SARS-CoV-2 主要蛋白酶的潜力。SAR 数据显示,合成的噻二唑基噻唑烷酮衍生物对目标酶具有显著的抑制作用。不同的取代化合物 1(IC50 = 0.10 µM)、2(IC50 = 1.43 µM)、4(IC50 = 2.25 µM)、5(IC50 = 24.56 µM)、6(IC50 = 26.47 µM)和 8(IC50 = 19.59 µM)具有极佳的潜力,甚至比其标准药物 GC-376 (IC50 = 0.439 µM)更强。在该系列的强效候选化合物中,元位含有 CF3、正位含有 NO2 的化合物 1 潜力最大,是 SARS-CoV-2 蛋白酶的极佳抑制剂。此外,还对这些强效类似物进行了分子对接研究,以探索它们与 SARS-CoV-2 3CL 蛋白酶活性位点的结合相互作用。这项研究还进行了 ADME 分析,以评估该系列先导化合物的药物亲和性。
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引用次数: 0
One-pot synthesis of dihydropyrimidinone and polyhydroquinoline derivatives with natural deep eutectic solvents (NADESs): Alternative to toxic organic solvents and environmental eco-friendly 利用天然深共晶溶剂 (NADES) 一锅合成二氢嘧啶酮和多氢喹啉衍生物:有毒有机溶剂的替代品和环保型溶剂
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-10 DOI: 10.1016/j.rechem.2024.101848
Sedigheh Ayazi Jannatabadi, Rahman Hosseinzadeh, Behrooz Maleki
Natural deep eutectic solvents (NADESs) have emerged as a novel class of solvents with properties reminiscent of ionic liquids while offering additional advantages in terms of cost, environmental impact, and synthesis. This article focuses on the applications of NADESs of mannose:urea and glucose:dimethylurea as inexpensive, accessible, and reusable catalysts in the synthesis of dihydropyrimidinone and polyhydroquinoline derivatives. The results demonstrate significant yields for both dihydropyrimidinones (47–99%) and polyhydroquinolines (90–97%) reactions using mannose:urea and glucose:dimethylurea as catalysts. The advantages of NADESs as catalysts include their simple and reproducible preparation, low cost, environmentally benign nature, long-term durability, and tunable properties. This NADESs can also be recovered and reused for four times without a significant loss of activity.
天然深共晶溶剂(NADES)是一类新型溶剂,其性质与离子液体相似,但在成本、环境影响和合成方面具有更多优势。本文重点介绍了甘露糖:脲和葡萄糖:二甲基脲的 NADES 作为廉价、易获得和可重复使用的催化剂在合成二氢嘧啶酮和聚氢喹啉衍生物中的应用。研究结果表明,使用甘露糖:脲和葡萄糖:二甲基脲作为催化剂,二氢嘧啶酮(47-99%)和多氢喹啉(90-97%)反应的产率都很高。NADES 作为催化剂的优点包括制备简单、可重复性好、成本低、对环境无害、长期耐久性和可调特性。这种 NADES 还可以回收并重复使用四次,而不会明显丧失活性。
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引用次数: 0
A novel sandwich ELISA method for quantifying CHI3L1 in blood serum and cerebrospinal fluid multiple sclerosis patients using sustainable photo-irradiated zero-valence gold nanoparticles 利用可持续光辐射零价金纳米粒子的新型夹心 ELISA 方法定量检测多发性硬化症患者血清和脑脊液中的 CHI3L1
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101856
Marwa Saad Mohammed, Salwa H.N. Al-Rubaeꞌi, Ahmed Mahdi Rheima, Fatin Fadhel Al-Kazazz
The widespread occurrence of chronic demyelinating MS presents a significant challenge for ongoing research aimed at comprehending its progression, diagnosis, and treatment. In our research, we have devised a novel approach to quantify CHI3L1 (Chitinase-3-like protein 1), which has emerged as a valuable biomarker in MS because of its involvement in inflammation, tissue remodeling, and immune response—crucial factors in regulating damaged nerve cells and preventing their accumulation in the brain, utilizing sandwich ELISA technology. This innovative method primarily depends on gold nanoparticles synthesized through a novel process of photo-irradiation with ultraviolet light. The crystal structure and particle size of sustainable zero-valent gold nanoparticles were measured using X-ray diffraction (XRD), which proved the cubic shape, with a cubic unit cell edge length of 4.0095 Å. The transmission electron microscopy (TEM) and field emission scanning electron microscope (FE-SEM) demonstrated that the distribution of Au NPs is uniform, with an average diameter of 22 nm. The UV–Vis spectrum, displaying a pronounced absorbance peak at a wavelength of 548 nm, suggests the presence of Au NPs. The optimal conditions for the formation of the Au-biotinylated antibody-HRP complex were studied. The optimum pH was 7, the dilution ratio of AuNPs with biotinylated antibody-HRP was 1:3, and the concentration of nanogold was (1 × 10−3 mg/ml) to avoid increasing it. Then a standard curve was drawn for this method and compared to the traditional method, and it was found to be twice as sensitive as the traditional method, with a high accuracy of CV% (3–6 %) as well as a rapid color generation for measurement. This method, based on gold nanoparticles that are considered a carrier for biotinylated antibody-HRP, was applied for the first time to measure CHI3L1 in the sera and cerebrospinal fluid of patients with multiple sclerosis, and the results demonstrated the accuracy and sensitivity of the method. The method has the potential to be an excellent tool for evaluating CHI3L1 and may have applications in other diseases for rapid diagnosis and timely treatment.
慢性脱髓鞘性多发性硬化症的广泛发生给正在进行的旨在了解其进展、诊断和治疗的研究带来了重大挑战。CHI3L1(几丁质酶-3 样蛋白 1)因参与炎症、组织重塑和免疫反应而成为多发性硬化症的重要生物标志物。这种创新方法主要依赖于通过紫外线光照射新工艺合成的金纳米粒子。透射电子显微镜(TEM)和场发射扫描电子显微镜(FE-SEM)表明,金纳米粒子分布均匀,平均直径为 22 纳米。紫外可见光谱在 548 纳米波长处显示出明显的吸光峰,表明金氧化物的存在。研究了形成 Au 生物素化抗体-HRP 复合物的最佳条件。最佳 pH 值为 7,AuNPs 与生物素化抗体-HRP 的稀释比为 1:3,纳米金的浓度为(1 × 10-3 mg/ml),以避免增加纳米金的浓度。然后绘制了该方法的标准曲线,并与传统方法进行了比较,结果发现该方法的灵敏度是传统方法的两倍,CV%(3-6 %)的准确度高,而且测量时可快速显色。该方法以金纳米粒子为生物素化抗体-HRP的载体,首次应用于测定多发性硬化症患者血清和脑脊液中的CHI3L1,结果表明了该方法的准确性和灵敏度。该方法有望成为评估 CHI3L1 的绝佳工具,并可应用于其他疾病的快速诊断和及时治疗。
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引用次数: 0
Acridine yellow G as a photo-induced electron transfer catalyzed radical [4 + 2] aza-Diels-Alder annulation of imines 吖啶黄 G 作为光诱导电子传递催化的自由基[4 + 2]氮杂-Diels-Alder 环化亚胺
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101843
Farzaneh Mohamadpour
For the preparation of polyfunctionalized piperidine scaffolds, a radical tandem five-condensation domino Knoevenagel-intramolecular [4 + 2] aza-Diels-Alder imin-based reaction was used. Based on acridine yellow G (AYG) as a photo-induced electron transfer (PET) photocatalyst, employing visible light as a renewable source of energy. AYG that is photochemically catalyzed has good yields, as well as outstanding atom economy, and ease of operation. As a result, a diverse set of chemical and environmental parameters can be measured across time. The turnover number (TON) and turnover frequency (TOF) of polyfunctionalized piperidine scaffolds have been computed. Also, gram-scale cyclization can occur, suggesting that the process might find application in industry.
为了制备多官能团化的哌啶支架,我们采用了基于自由基串联五缩合多米诺Knoevenagel-分子内[4 + 2] aza-Diels-Alder亚氨基反应。以吖啶黄 G(AYG)作为光诱导电子转移(PET)光催化剂,利用可见光作为可再生能源。光化学催化的 AYG 具有良好的产率、出色的原子经济性和操作简便性。因此,可以跨时间测量各种化学和环境参数。我们计算了多官能化哌啶支架的周转次数(TON)和周转频率(TOF)。此外,克级规模的环化也可以发生,这表明该过程可能会在工业中得到应用。
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引用次数: 0
Effect of Cu substitution on morphological optical and electrochemical properties of Co3O4 nanoparticles by co-precipitation method 共沉淀法 Cu 置换对 Co3O4 纳米粒子形态光学和电化学性能的影响
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101830
R. Sakthi Murugan , Pitchai Sali Mohamed Hajasharif , C. Manoharan , A. Dinesh , S. Suthakaran , Manikandan Ayyar , Mohamed Hashem , Hassan Fouad
In this present study, pure Co3O4 and Cu-substituted Co3O4 nanoparticles (NPs) were prepared by a simple co-precipitation method and their structural, morphological, optical, and electrochemical properties were assessed. X-ray diffraction (XRD) analysis indicated that the synthesized samples had a cubic structure with the formation of a secondary phase (CuO) was detected at a higher Cu concentration. The average crystallite was decreased with increasing Cu content. Fourier transform infra-red (FT-IR) analysis revealed that the presence of vibrational bands in Cu-substituted Co3O4 NPs. The morphological study of the pure Co3O4 and Cu-substituted Co3O4 NPs revealed that the hexagonal structure with porous morphology confirmed by Field emission scanning electron microscopy (FESEM). High resolution transmission electron microscope (HR-TEM) analysis with spotty diffraction rings showed that pure Co3O4 and Cu-substituted Co3O4 NPs were polycrystalline in nature. The optical properties of synthesized samples exhibited strong absorption edges, and bandgap values were found to be increased from 3.60 to 3.75 eV. Cyclic voltammetry (CV) was employed to investigate the electrochemical properties of the synthesized materials. The CV curves exhibited pseudocapacitive behavior, and 2 % Cu substituted Co3O4 electrode had a high higher specific capacitance value than pure Co3O4 electrode.
本研究采用简单的共沉淀法制备了纯 Co3O4 和 Cu 取代 Co3O4 纳米粒子 (NPs),并评估了它们的结构、形态、光学和电化学特性。X 射线衍射(XRD)分析表明,合成的样品具有立方结构,在较高的铜浓度下可检测到第二相(CuO)的形成。平均晶粒随着铜含量的增加而减少。傅立叶变换红外(FT-IR)分析表明,Cu 取代的 Co3O4 NPs 中存在振动带。场发射扫描电子显微镜(FESEM)对纯 Co3O4 和 Cu 取代 Co3O4 NPs 的形态研究表明,它们具有多孔的六边形结构。高分辨率透射电子显微镜(HR-TEM)和斑点衍射环分析表明,纯 Co3O4 和 Cu 取代 Co3O4 NPs 具有多晶性质。合成样品的光学特性表现出很强的吸收边缘,带隙值从 3.60 eV 增加到 3.75 eV。采用循环伏安法(CV)研究了合成材料的电化学特性。CV 曲线显示出假电容行为,2% 铜取代 Co3O4 电极的比电容值高于纯 Co3O4 电极。
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引用次数: 0
Antibacterial and antioxidant activities of a new phenolic coumpound from the roots barks of Cassia arereh Delile (Fabaceae) 决明子根皮(豆科植物)中一种新酚类化合物的抗菌和抗氧化活性
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101802
Néomi Chefo Kengne , Honoré Wangso , Isaac Silvère Gade , Alphonse Laya , Jean Paul Bayang , Benoît Bargui Koubala , Sophie Laurent , Celine Henoumont , Emmanuel Talla
Phytochemical study of the root barks of Cassia arereh resulted in the isolation of a new phenolic ester, 3′-hydroxy-4′-methoxystyrenyl-(E)-p-coumarate (1) isolated for the first time from natural source, alongside eight known compounds (29). Compounds 1, 7 and 8 are depicted for the first time from Cassia genus. The structures of all compounds were established through NMR analysis (1D and 2D), High Resolution Mass Spectrometry (HRMS) and comparison with previously reported data in literature. Antioxidant activity was investigated through DPPH method while the antibacterial activity was done by the disc diffusion method on Escherichia coli and Salmonella typhimurium strains. Results showed that the methanol extract and compound 7 displayed significant (p < 0.01) DPPH radical scavenging activity which is comparable to BHT used as standard with IC50 values of 118.04 and 122.24 µg/mL respectively. Otherwise, the same extract and compound 7 also showed significant antibacterial activity against S. typhi and E. coli with MIC values of 30 and 40 µg/mL, respectively.
This research confirm the traditional use of Cassia arereh to treat ailments and provide supplementary data on its chemical profile and pharmacological potential.
通过对 Arereh 决明根皮进行植物化学研究,首次从天然来源中分离出一种新的酚酯,即 3′-羟基-4′-甲氧基苯乙烯基-(E)-p-香豆酸酯(1),以及 8 种已知化合物(2-9)。化合物 1、7 和 8 是首次从决明属植物中发现的。所有化合物的结构都是通过核磁共振分析(一维和二维)、高分辨质谱分析(HRMS)以及与之前文献报道的数据进行比较后确定的。抗氧化活性通过 DPPH 法进行了研究,而抗菌活性则通过盘扩散法对大肠杆菌和鼠伤寒沙门氏菌进行了研究。结果表明,甲醇提取物和化合物 7 显示出显著的 DPPH 自由基清除活性(p < 0.01),其 IC50 值分别为 118.04 和 122.24 µg/mL ,与用作标准的 BHT 相当。此外,同一提取物和化合物 7 对伤寒杆菌和大肠杆菌也显示出显著的抗菌活性,其 MIC 值分别为 30 和 40 µg/mL 。
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引用次数: 0
Corrigendum to “The impact of pH value on the transfer and release dynamics of doxorubicin facilitated by carbon nanotubes within the capillary network surrounding cancerous tumors through molecular dynamics simulation” [Res. Chem. 11 (2024) 101769] 更正:"通过分子动力学模拟研究pH值对碳纳米管在癌症肿瘤周围毛细管网络中促进多柔比星转移和释放动力学的影响" [Res. Chem. 11 (2024) 101769]
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101817
Ibrahim Saeed Gataa , Zainab Younus Abdullah , Abdulrahman A. Almehizia , Amer Alhaj Zen , Soheil Salahshour , M. Pirmorad
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引用次数: 0
Chemical approaches for wastewater and pollutant treatment 废水和污染物处理的化学方法
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101821
Sankarasekaran Shanmugaraju
{"title":"Chemical approaches for wastewater and pollutant treatment","authors":"Sankarasekaran Shanmugaraju","doi":"10.1016/j.rechem.2024.101821","DOIUrl":"10.1016/j.rechem.2024.101821","url":null,"abstract":"","PeriodicalId":420,"journal":{"name":"Results in Chemistry","volume":"11 ","pages":"Article 101821"},"PeriodicalIF":2.5,"publicationDate":"2024-10-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142531214","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"OA","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Biosynthesis of cobalt oxide nanoparticles and their cytotoxicity against cancer cells mouse colon adenocarcinoma cell line 氧化钴纳米粒子的生物合成及其对癌细胞的细胞毒性 小鼠结肠腺癌细胞系
IF 2.5 Q2 CHEMISTRY, MULTIDISCIPLINARY Pub Date : 2024-10-01 DOI: 10.1016/j.rechem.2024.101839
Ali Talib al Alawi , Mohammad Talib al Alawi , Nasim Hayati Roodbari , Ali Es-haghi , Mohammad Mashreghi
The application of plant extracts for the biosynthesis of cobalt oxide nanoparticles is eco-friendly, more economical, less toxic, and more biocompatible. In this study, we used Rose hip extract to synthesize cobalt oxide nanoparticles (Co3O4 NPs). The biosynthesized cobalt oxide nanoparticles were characterized by FT-IR spectroscopy, X-ray diffraction (XRD), and scanning electron microscopy (SEM). The PXRD and FTIR analyses confirmed the successful synthesis and the characteristic bands of Co3O4 NPs, respectively. The FESEM image showed that the Co3O4 NPs were approximately spherical morphology with a mean size of 90.77 ± 32.35 nm. The EDX analysis showed the elemental composition contains carbon in the formulation of Co3O4 NPs. The results showed that the plant extracts can be used to synthesiz cobalt oxide nanoparticles with good quality at nanoscale sizes. The as-prepared Co3O4 NPs exhibited excellent cell toxicity properties against mouse colon adenocarcinoma cells, indicating that biosynthesized cobalt oxide nanoparticles have potential applications in cancer and nanomedicine.
将植物提取物用于氧化钴纳米粒子的生物合成,具有环保、经济、毒性低、生物相容性好等优点。在这项研究中,我们利用玫瑰果提取物合成了氧化钴纳米粒子(Co3O4 NPs)。通过傅立叶变换红外光谱、X射线衍射(XRD)和扫描电子显微镜(SEM)对生物合成的氧化钴纳米粒子进行了表征。PXRD 和 FTIR 分析分别证实了 Co3O4 NPs 的成功合成和特征谱带。FESEM 图像显示,Co3O4 NPs 形状近似球形,平均尺寸为 90.77 ± 32.35 nm。EDX 分析表明,Co3O4 NPs 的元素组成中含有碳元素。结果表明,植物提取物可用于合成纳米级尺寸的优质氧化钴纳米粒子。制备的 Co3O4 NPs 对小鼠结肠腺癌细胞具有良好的细胞毒性,表明生物合成的氧化钴纳米粒子在癌症和纳米医学方面具有潜在的应用价值。
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引用次数: 0
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Results in Chemistry
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