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1.
Environ Pollut ; 341: 122915, 2024 Jan 15.
Artículo en Inglés | MEDLINE | ID: mdl-37952917

RESUMEN

In this work, the removal and transformation process of diethyl phthalate (DEP) in UV/dichloroisocyanurate (UV/DCCNa) and UV/sodium hypochlorite (UV/NaClO) systems were compared to evaluate the application potential of UV/DCCNa technology. Compared with UV/NaClO, UV/DCCNa process has the advantage of DEP removal and caused a higher degradation efficiency (93.8%) within 45 min of oxidation in ultrapure water due to the sustained release of hypochloric acid (HOCl). Fourteen intermediate products were found by high-resolution mass spectrometry, and the transformation patterns including hydroxylation, hydrolysis, chlorination, cross-coupling, and nitrosation were proposed. The oxidation processes were also performed under quasi-realistic environmental conditions, and it was found that DEP could be effectively removed in both systems, with yields of disinfection byproduct meeting the drinking water disinfection standard (<60.0 µg/L). Comparing the single system, the removal of DEP decreased in the mixed system containing five kinds of PAEs, which could be attributed to the regeneration of DEP and the competitive effect of •OH occurred among the Dimethyl phthalate (DMP), DEP, Dipropyl phthalate (DPrP), Diallyl phthalate (DAP) and Diisobutyl phthalate (DiBP). However, a greater removal performance presented in UV/DCCNa system compared with UV/NaClO system (69.4% > 62.1%). Further, assessment of mutagenicity and developmental toxicity by Toxicity Estimation Software Tool (T.E.S.T) software indicated that UV/DCCNa process has fewer adverse effects on the environment and is a more environmentally friendly chlorination method. This study may provide some guidance for selecting the suitable disinfection technology for drinking water treatment.


Asunto(s)
Agua Potable , Ácidos Ftálicos , Contaminantes Químicos del Agua , Purificación del Agua , Agua Potable/análisis , Contaminantes Químicos del Agua/análisis , Ácidos Ftálicos/toxicidad , Oxidación-Reducción , Purificación del Agua/métodos
2.
Int J Biol Macromol ; 256(Pt 2): 128528, 2024 Jan.
Artículo en Inglés | MEDLINE | ID: mdl-38040164

RESUMEN

Herein, a mixture of eggshell (ES) and magnetite nanoparticles (MNPs) was alkali-activated using NaOH/Na2SiO3 solution and then, impregnated with sodium alginate (SA) to prepare a magnetic bio-based adsorbent (namely SAAES/SA/MNPs) for the decontamination of water containing basic dyes, in particular, methylene blue (MB) and crystal violet (CV). The physicochemical properties of magnetic spheres of SAAES/SA/MNPs were characterized using XRD, FTIR, FESEM, EDX, elemental mapping, TEM, and zeta potential techniques. Dye adsorption equilibrium was studied experimentally at pH 8.0 and 25-55 °C, and a statistical physics multilayer model was applied to understand the removal mechanism of these dyes including the adsorption orientations on the adsorbent surface. The number of adsorbed dye molecules per functional group (n) of this bio-based adsorbent ranged from 0.70 to 0.91, indicating the presence of vertical and horizontal adsorption orientations for these organic molecules at all tested solution temperatures. The calculated saturation adsorption capacities (Qsat) were 332.57-256.62 mg/g for CV and 304.47-240.62 mg/g for MB, and an exothermic adsorption was observed for both adsorbates. The estimated adsorption energies (∆E) were < 25 kJ/mol, confirming that the SAAES/SA/MNPs-dye interactions were governed by physical forces as electrostatic interactions. This bio-based adsorbent was effectively regenerated using ethanol and it can be reused showing a removal of 71 and 74 % of MB and CV, respectively, after fourth adsorption-desorption cycles. Overall, the results of this article suggest the attractive performance of SAAES/SA/MNPs for removing basic dyes from aqueous solutions, thus highlighting the promising potential of this magnetic bio-based adsorbent for sustainable wastewater treatment at an industrial level.


Asunto(s)
Nanopartículas , Contaminantes Químicos del Agua , Animales , Adsorción , Colorantes/química , Álcalis , Cáscara de Huevo/química , Cationes , Azul de Metileno/química , Fenómenos Magnéticos , Contaminantes Químicos del Agua/química , Concentración de Iones de Hidrógeno , Cinética
3.
Chemosphere ; 338: 139292, 2023 Oct.
Artículo en Inglés | MEDLINE | ID: mdl-37437618

RESUMEN

Marine hazardous contaminants, such as cadmium (Cd) and lead (Pb), pose significant risks to both human health and aquatic organisms. Traditional methods may not remove contaminants to safe levels, leading to the release of hazardous materials into marine environments. This research proposes polymeric membrane bioreactors as a potential solution to this problem. We determined Cd and Pb levels in three freshwater fish species (Rita, Ompok bimaculatus, and Heteropneustes fossils) from two distinctive regions (Zone 1 and Zone 2). Additionally, Cd and Pb concentrations in feeding materials, water, and sediments were analyzed to estimate daily intake and potential hazardous effects of these contaminants on the fish species. These findings underscore the need for effective regulatory measures and policies to reduce the discharge of hazardous contaminants into freshwater and marine environments, protecting both human health and the environment. Implementing polymeric membrane bioreactors in wastewater treatment and industrial facilities could mitigate the risks associated with consuming contaminated fish species. Significantly, the Cd and Pb levels in all three fish species from both fishponds exceeded the Food and Agriculture Organization's (FAO) maximum permissible limits. These findings carry important implications for policymakers, regulators, and industries, urging them to act appropriately to ensure the safety of the environment and public health. This study suggests that polymeric membrane bioreactors are a promising technological approach to address marine contamination, emphasizing their potential role in safeguarding human health and aquatic ecosystems.


Asunto(s)
Metales Pesados , Contaminantes Químicos del Agua , Animales , Humanos , Cadmio , Ecosistema , Plomo , Agua Dulce , Sustancias Peligrosas , Medición de Riesgo , Metales Pesados/análisis , Contaminantes Químicos del Agua/análisis , Monitoreo del Ambiente/métodos
4.
Chemosphere ; 338: 139501, 2023 Oct.
Artículo en Inglés | MEDLINE | ID: mdl-37453525

RESUMEN

The remediation of wastewater with microalgae is a new topic that concentrates on devising a cost-effective and environmentally beneficial method. Multiple microalgae and bacterial consortiums have recently been evaluated to determine if they can purify effluent from various sources. Critical to a system's efficacy is its ability to remove nutrients such as nitrogen (N) and phosphorus (P) and heavy metals such as arsenic (As), lead (Pb), and copper (Cu). This study compared traditional wastewater treatment systems to microalgae-based systems for treating different types of wastewater. The research investigates the potential for microalgae to cleanse wastewater. The research also evaluates wastewater parameters, methods, and scientific techniques for extracting nutrients and heavy metals from polluted water. According to the literature, Microalgae can remove between 98.7% and 100% of nitrogen (N), phosphorous (P), and heavy metals from various effluents. The paper concludes by discussing the difficulties of using microalgae to remediate wastewater. The elimination of nutrients from the effluent is influenced by biomass production, osmotic capacity, temperature, pH, and O2 concentration. Therefore, a "pilot" study is recommended to investigate contaminants.


Asunto(s)
Metales Pesados , Microalgas , Purificación del Agua , Aguas Residuales , Nitrógeno , Purificación del Agua/métodos , Fósforo , Biomasa
5.
Chemosphere ; 336: 139189, 2023 Sep.
Artículo en Inglés | MEDLINE | ID: mdl-37307926

RESUMEN

In this study, the oxidation of 1-naphthol (1-NAP) and 2-naphthol (2-NAP) by Fe(VI) was investigated. The impacts of operating factors were investigated through a series of kinetic experiments, including Fe(VI) dosages, pH and coexisting ions (Ca2+, Mg2+, Cu2+, Fe3+, Cl-, SO42-, NO3- and CO32-). Almost 100% elimination of both 1-NAP and 2-NAP could be achieved within 300 s at pH 9.0 and 25 °C. Cu2+ could significantly improve the degradation efficiency of 1-NAP and 2-NAP, but the impacts of other ions were negligible. The liquid chromatography-mass spectrometry was used to identify the transformation products of 1-NAP and 2-NAP in Fe(VI) system, and the degradation pathways were proposed accordingly. Electron transfer mediated polymerization reaction was the dominant transformation pathway in the elimination of NAP by Fe(VI) oxidation. After 300 s of oxidation, heptamers and hexamers were found as the final coupling products during the removal of 1-NAP and 2-NAP, respectively. Theoretical calculations demonstrated that the hydrogen abstraction and electron transfer reaction would easily occur at the hydroxyl groups of 1-NAP and 2-NAP, producing NAP phenoxy radicals for subsequent coupling reaction. Moreover, since the electron transfer reactions between Fe(VI) and NAP molecules were barrierless and could occur spontaneously, the theoretical calculation results also confirmed the priority of coupling reaction in Fe(VI) system. This work indicated that the Fe(VI) oxidation was an effective way for removing naphthol, which may help us understand the reaction mechanism between phenolic compounds with Fe(VI).


Asunto(s)
Contaminantes Químicos del Agua , Purificación del Agua , Naftoles , Cinética , Oxidación-Reducción , Contaminantes Químicos del Agua/química , Purificación del Agua/métodos
6.
Water Res ; 238: 120034, 2023 Jun 30.
Artículo en Inglés | MEDLINE | ID: mdl-37150061

RESUMEN

Benzophenones (BPs) are commonly used as UV filters in cosmetics and plastics products and are potentially toxic to the environment. This paper presents kinetics and products of BPs oxidation by ferrate(VI) (FeO42-, Fe(VI)) promoted by permanganate (Mn(VII)) . Degradation of 10.0 µM 2,2'-dihydroxy-4-methoxybenzophenone (BP-8)were determined under different experimental conditions ([Mn(VII)] = 0.5-1.5 µM, [Fe(VI)] = 50-150 µM, and pH = 7.0-10.0). The addition of Mn(VII) traces to Fe(VI)-BP-8 solution enhanced kinetics and efficiency of the removal. Similar enhanced removals were also seen for other BPs (BP-1, BP-3, and BP-4) under optimized conditions. The second-order rate constants (k, M-1s-1) of the degradation of BPs showed positive relationship with the energy of the highest occupied orbital (EHOMO). The possible interaction between Mn(VII) and BP-8 and the enhanced generation of Fe(V)/Fe(IV) and •OH was proposed to facilitate the oxidation of the target benzophenone, supported by in-situ electrochemical measurements, theoretical calculations and reactive species quenching experiments. Thirteen oxidation products of BP-8 suggested hydroxylation, bond breaking, polymerization and carboxylation steps in the oxidation. Toxicity assessments by ECOSAR program showed that the oxidized intermediate products posed a tapering ecological risk during the degradation process. Overall, the addition of Mn(VII) could improve the oxidation efficiency of Fe(VI).


Asunto(s)
Manganeso , Contaminantes Químicos del Agua , Manganeso/química , Contaminantes Químicos del Agua/química , Oxidación-Reducción , Benzofenonas , Cinética
7.
Front Chem ; 11: 1130682, 2023.
Artículo en Inglés | MEDLINE | ID: mdl-37051069

RESUMEN

A sub-bituminous natural coal sample (R.C) was treated with sulfuric acid (S.C) and nitric acid (N.C) as modified products and enhanced adsorbents for obtaining ciprofloxacin (CFX) antibiotic residuals from water. The characterization studied demonstrates enhancement in the surface area and the incorporation of new active oxygenated, sulfur-bearing, and nitrogen-bearing chemical groups into the structure of coal samples. This was reflected in the adsorption capacities that were enhanced from 164.08 mg/g (R.C) to 489.2 mg/g and 518.5 mg/g for N.C and S.C, respectively. The impact of the acid modification processes was evaluated based on the energetic and steric properties of their adsorption systems considering the parameters of the advanced monolayer equilibrium model with one energy site. The determined occupied active sites' density of R.C (46.32-61.44 mg/g), N.C (168.7-364.9 mg/g), and S.C (159.2-249.9 mg/g) reflects an increase in the quantities of active centers after the acid treatment processes, especially with HNO3. The higher efficiencies of the active sites of S.C to adsorb more CFX molecules (n = 2.08-2.31) than N.C (n = 1.41-2.16) illustrate its higher adsorption capacity. The energetic investigation [adsorption (˂40 kJ/mol) and Gaussian (˂8 kJ/mol) energies] suggested adsorption of CFX by N.C and S.C mainly by physical processes such as van der Waals forces, hydrogen bonding, dipole bonding, and π-π interactions. Moreover, the determined thermodynamic functions including entropy, internal energy, and free enthalpy reflect the spontaneous and endothermic uptake of CFX on the surfaces of N.C and S.C.

8.
Chemosphere ; 316: 137774, 2023 Mar.
Artículo en Inglés | MEDLINE | ID: mdl-36642137

RESUMEN

The removal of Bisphonel AF (BPAF) by zero-valent iron activated persulfate (Fe0/PS) system was systematically evaluated in this work. 30.0 µM BPAF was removed by 94.4% in 60 min of treatment under optimal conditions of pH = 3.0 and [PS] = [Fe0] = 3.0 mM. Cl- significantly accelerated the removal of BPAF, resulting from accelerated Fe2+ release and reactive chlorine species (RCS) formation. Liquid chromatography-time-of-flight-mass spectrometry identified thirteen degradation products, and bond breaking, coupling reactions, hydroxylation and sulfate addition were considered as the major transformation pathways. When Cl- was present, six new chlorinated byproducts were also generated. Based on density functional theory (DFT) calculations, the occurrence of radical addition reactions was verified and the preferential reaction channels were determined. Significantly BPAF degradation products were less toxic, according to toxicity assessment by the ECOSAR program. Moreover, a high removal efficiency of BPAF (>90%) was also obtained in the three actual water matrixes. The present work demonstrates the feasibility of Fe0/PS system for treating BPAF, which could also provide new insights into the influence of coexisting Cl- on the environmental fate of organic pollutants in sulfate radicals based advanced oxidation processes.


Asunto(s)
Cloruros , Contaminantes Químicos del Agua , Hierro/química , Cinética , Contaminantes Químicos del Agua/toxicidad , Oxidación-Reducción , Sulfatos/química
9.
J Hazard Mater ; 445: 130475, 2023 03 05.
Artículo en Inglés | MEDLINE | ID: mdl-36455331

RESUMEN

The transformation process of contaminants on microplastics (MPs) exposed to sunlight has attracted increasing attention. However, the interactions between them are typically disregarded; therefore, this work investigated the photodegradation of 2,2',4,4'-tetrabromodiphenyl ether (BDE-47) on three MPs (polystyrene (PS), polypropylene (PP) and polyethylene (PE)) and the interactions between these two. The inhibition of aged PS on the elimination of BDE-47 was due to light shielding, while aged PP and PE increased the degradation rate. More hydroxyl radicals (HO•) was detected in the PS system, which resulted in the higher degradation rate of BDE-47 on PS. A total of 33 different products were identified and four reaction pathways were presented, and the reaction mechanisms mainly included debromination, hydroxylation, carbon-oxygen-bond breaking and interactive reactions. The Ecological Structure Activity Relationship (ECOSAR) and Toxicity Estimation Software Tool (TEST) programs were used to evaluate the toxicity of reaction products, and the results indicated that even though BDE-47 was the most toxic, the interaction products were still toxic or harmful to aquatic organisms. This study provides significant information on the photodegradation of contaminants on common microplastics and their interaction, which cannot be ignored.


Asunto(s)
Microplásticos , Contaminantes Químicos del Agua , Plásticos/toxicidad , Éter , Fotólisis , Poliestirenos/toxicidad , Polipropilenos , Polietileno , Contaminantes Químicos del Agua/toxicidad
10.
Environ Sci Pollut Res Int ; 30(2): 2836-2849, 2023 Jan.
Artículo en Inglés | MEDLINE | ID: mdl-35939190

RESUMEN

Heavy metals (HMs) constitute a group of persistent toxic pollutants, and the petroleum industry is one of the sources of these metals. This study aimed to evaluate the levels of lead (Pb), cadmium (Cd), nickel (Ni), and vanadium (V) in Plantago ovata and milk and tissues of domestic goats in the eastern region of Saudi Arabia. Plant samples and blood, milk, muscle, liver, and kidney samples were collected from domestic goats and the levels of Pb, Cd, V, and Ni were determined. Liver and kidney tissue injury, oxidative stress, and expression of pro-inflammatory and apoptosis markers were evaluated. Pb, Cd, V, and Ni were increased in Plantago ovata as well as in milk, blood, muscle, liver, and kidney of goats collected from the polluted site. Aminotransferases, creatinine, and urea were increased in serum, and histopathological changes were observed in the liver and kidney of goats at the oil extraction site. Malondialdehyde and the expression levels of pro-inflammatory cytokines, Bax, and caspase-3 were increased, whereas cellular antioxidants and Bcl-2 were decreased in liver and kidney of goats at the polluted site. In conclusion, petroleum industry caused liver and kidney injury, oxidative stress, and upregulated pro-inflammatory and apoptosis markers in goats. These findings highlight the negative impact of petroleum industry on the environment and call attention to the assessment of its effect on the health of nearby communities.


Asunto(s)
Cadmio , Metales Pesados , Animales , Cadmio/metabolismo , Cabras/metabolismo , Arabia Saudita , Plomo/metabolismo , Metales Pesados/análisis , Níquel/análisis , Estrés Oxidativo , Industria del Petróleo y Gas
11.
ACS Omega ; 7(41): 36697-36711, 2022 Oct 18.
Artículo en Inglés | MEDLINE | ID: mdl-36278107

RESUMEN

Natural coal (N.C) was sulfonated with sulfuric acid by normal stirring (MS.C) and sonication waves (SS.C) to obtain -SO3H functionalized coal as enhanced adsorbents of malachite green dye (MG). The sulfonated products exhibit enhanced surface area (MS.C (27.2 m2/g) and SS.C (45.8 m2/g)) as compared to N.C. SS.C achieved higher acid density (14.2 mmol/g) and sulfur content (13.2 wt. %) as compared to MS.C. The impact of the sulfonation processes on the adsorption of MG was assessed based on the monolayer isotherm model of one energy. The MG Q sat of N.C (121.3 mg/g), MS.C (226.3 mg/g), and SS.C (296.4 mg/g) validate the significant effect of the sulfonation processes by the sonication waves. This is in agreement with the active site densities that reflect the saturation of SS.C by more active sites (180.74 mg/g) than MS.C (120.38 mg/g) and N.C (70.84 mg/g). The MS.C and SS.C can adsorb three MG molecules as compared to two molecules per site of N.C. The Gaussian energy (<8 kJ/mol) and adsorption energy (<40 kJ/mol)) reflects the physisorption of MG involving van der Waals forces, hydrogen bonding, and dipole bonding forces. The thermodynamic functions demonstrate the uptake of MG by exothermic, spontaneous, feasible reactions.

12.
ACS Omega ; 7(8): 6991-7001, 2022 Mar 01.
Artículo en Inglés | MEDLINE | ID: mdl-35252690

RESUMEN

Herein, natural zeolite (clinoptilolite) was functionalized by Na+ ions (G.Na+/Clino) utilizing a green tea extract prepared by a green production method as a potential carrier for the 5-fluorouracil (5-Fu) drug with enhanced physicochemical behaviors. The G.Na+/Clino-modified product showed enhanced surface area (312 m2/g) and ion-exchange capacity (387 mequiv/100 g). The loading studies reflect high and controlled loading properties of G.Na+/Clino with an actual loading capacity of 291 and 462 mg/g, respectively. The loading reactions of 5-Fu into G.Na+/Clino were of pseudo-second-order kinetics and exhibited Langmuir isotherm properties. This suggested a monolayer and homogeneous loading process by chemical complexation and ion-exchange mechanisms with a Gaussian energy value of 10.47 kJ/mol. Additionally, these reactions were of endothermic and spontaneous nature based on the determined thermodynamic parameters. The release studies demonstrated the 5-Fu release profile for about 150 h at pH 1.2 and for 80 h at pH 7.4. The release reactions had non-Fickian transport properties and were controlled by both erosion and diffusion mechanisms, considering the release kinetic findings and the values of the diffusion exponent (0.42 at pH 1.2 and 0.37 at pH 7.4). The composite showed remarkable biocompatibility based on the measured cell viability and a cytotoxic effect on normal colorectal cells (CCD-18Co). Additionally, the application of G.Na+/Clino as an inorganic carrier for the 5-Fu drug prompted the cytotoxic effect of the drug on colon cancer cell treatment (HCT-116).

13.
Animals (Basel) ; 12(6)2022 Mar 11.
Artículo en Inglés | MEDLINE | ID: mdl-35327104

RESUMEN

The petroleum industry can impact the environment and human health. Heavy metals (HMs), including lead (Pb), cadmium (Cd), nickel (Ni), and vanadium (V), are toxic pollutants found in petroleum that can cause several severe diseases. This study investigated the impact of the oil industry on the Arabian camel (Camelus dromedarius) in the eastern region of Saudi Arabia, pointing to HMs accumulation, tissue injury, redox imbalance, inflammation, and apoptosis. Soil and camel samples (milk, blood, muscle, liver, and kidney) were collected from a site near an oil industry field and another two sites to analyze HMs. Pb, Cd, Ni, and V were increased in the soil and in the camel's milk, blood, muscle, liver, and kidney at the polluted site. Serum aminotransferases, urea, and creatinine were elevated, and histopathological alterations were observed in the liver and kidney of camels at the oil industry site. Hepatic and renal lipid peroxidation, pro-inflammatory cytokines, Bax, and caspase-3 were increased, whereas cellular antioxidants and Bcl-2 declined in camels at the oil extraction site. In conclusion, the oil industry caused soil and tissue accumulation of HMs, liver and kidney injury, oxidative stress, and apoptosis in camels living close to the oil extraction site. These findings pinpoint the negative impact of the oil industry on the environment, animal, and human health.

14.
Environ Res ; 211: 113108, 2022 08.
Artículo en Inglés | MEDLINE | ID: mdl-35314161

RESUMEN

Decolorization of safranin was investigated using Fissidens species in a batch system under optimized conditions. The decolorization efficiency was improved by optimizing the conditions such as initial pH (3-9), temperature (25-45 °C), initial dye concentration (10-50 mg/L), biosorbent dosage (100-500 mg/L) and contact time (1-6 days). Maximum decolorization (95%) was recorded at initial pH of 6 with dye concentration of 20 mg/L, biosorbent dosage of 200 mg/L at 30 °C and contact time of 2 days. Desorption studies revealed 0.1 N NaOH as the best desorbing agent with 92% recovery on third day. Experimental data well fitted to Langmuir isotherm and Pseudo-second order kinetic model. The negative values of ΔGo and positive value of ΔSo and ΔHo indicates that the reaction is spontaneous, favorable and endothermic. The biosorbent - dye interactions were confirmed using UV-Vis, FT-IR, XRD and FE-SEM with EDX studies. The detoxified nature of the dye degraded metabolites was confirmed by the significant growth of green gram. The color fastness and color strength of the fabrics dyed using Fissidens species treated dye solution were compared with the tap water dyed fabrics which indicated the reuse potential of treated water in textile sector. The decolorization efficiency was further confirmed through in silico approach, where safranin well docked with the active sites of Photosystem II protein D1 of the Fissidens species. Thus, the present study proves that Fissidens species is a promising biosorbent for safranin decolorization and will lay a platform for the control and management of environmental pollution.


Asunto(s)
Contaminantes Químicos del Agua , Adsorción , Colorantes/química , Colorantes/toxicidad , Concentración de Iones de Hidrógeno , Cinética , Fenazinas , Espectroscopía Infrarroja por Transformada de Fourier , Termodinámica , Agua , Contaminantes Químicos del Agua/química
15.
Molecules ; 27(4)2022 Feb 14.
Artículo en Inglés | MEDLINE | ID: mdl-35209053

RESUMEN

Non-steroidal anti-inflammatory drugs (NSAIDs) are generally utilized for numerous inflammatory ailments. The long-term utilization of NSAIDs prompts adverse reactions such as gastrointestinal ulceration, renal dysfunction and hepatotoxicity; however, selective COX-2 inhibitors prevent these adverse events. Various scientific approaches have been employed to identify safer COX-2 inhibitors, as in any case, a large portion of particular COX-2 inhibitors have been retracted from the market because of severe cardiovascular events. This study aimed to develop and synthesize a novel series of indomethacin analogues with potential anti-inflammatory properties and fewer side effects, wherein carboxylic acid moiety was substituted using DCC/DMAP coupling. This study incorporates the docking of various indomethacin analogues to detect the binding interactions with COX-2 protein (PDB ID: 3NT1). MD simulation was performed to measure the stability and flexibility of ligand-protein interactions at the atomic level, for which the top-scoring ligand-protein complex was selected. These compounds were evaluated in vitro for COX enzymes inhibition. Likewise, selected compounds were screened in vivo for anti-inflammatory potential using the carrageenan-induced rat paw oedema method and their ulcerogenic potential. The acute toxicity of compounds was also predicted using in silico tools. Most of the compounds exhibited the potent inhibition of both COX enzymes; however, 3e and 3c showed the most potent COX-2 inhibition having IC50 0.34 µM and 1.39 µM, respectively. These compounds also demonstrated potent anti-inflammatory potential without ulcerogenic liability. The biological evaluation revealed that the compound substituted with 4-nitrophenyl was most active.


Asunto(s)
Antiinflamatorios no Esteroideos/química , Antiinflamatorios no Esteroideos/farmacología , Técnicas de Química Sintética , Diseño de Fármacos , Compuestos Heterocíclicos/química , Compuestos Heterocíclicos/farmacología , Antiinflamatorios no Esteroideos/síntesis química , Biomarcadores , Inhibidores de la Ciclooxigenasa 2/síntesis química , Inhibidores de la Ciclooxigenasa 2/química , Inhibidores de la Ciclooxigenasa 2/farmacología , Relación Dosis-Respuesta a Droga , Compuestos Heterocíclicos/síntesis química , Indometacina/síntesis química , Indometacina/química , Indometacina/farmacología , Ligandos , Simulación del Acoplamiento Molecular , Simulación de Dinámica Molecular , Estructura Molecular , Proteínas/química , Relación Estructura-Actividad
16.
Environ Res ; 209: 112809, 2022 06.
Artículo en Inglés | MEDLINE | ID: mdl-35104479

RESUMEN

The current study mainly focused on the fabrication of 2D graphitic carbon nitride-supported tin oxide nanoparticles (SnO2/g-C3N4) for the effective degradation of Amoxicillin (AMX). Tin oxide (SnO2) NPs were prepared by green and easy modification technique, and then it is decorated over g-C3N4 nanosheets. The structural morphology and surface composition of the synthesized SnO2/g-C3N4 nanocomposite were fully analysed by UV-Vis, XRD, XPS, and HR-SEM with EDAX, FT-IR, and BET analysis. The (HR-TEM) microscopy, the size of SnO2 NPs which as a diameter is about 6.2 nm. The Raman analysis revealed that the SnO2/g-C3N4 composite had a moderate graphitic structure, with a measured ID/Ig value of 0.79. The degradation efficiency of antibiotic pollutant AMX and pharma effluent treatment was monitored by UV spectroscopy. The optical band gap of SnO2 (2.9 eV) and g-C3N4 (2.8 eV) photocatalyst was measured by Tauc plots. To investigate the mechanism through the photodegradation efficiency of the catalyst was analysed by using different Scavenger EDTA-2Na holes (h+) has a greater contribution towards the degradation process. Under visible irradiation, SnO2/g-C3N4 nanocomposite has exhibited an excellent degradation performance of 92.1% against AMX and 90.8% for pharmaceutical effluent in 80 min.


Asunto(s)
Amoxicilina , Nanocompuestos , Catálisis , Preparaciones Farmacéuticas , Espectroscopía Infrarroja por Transformada de Fourier
17.
Molecules ; 27(3)2022 Feb 01.
Artículo en Inglés | MEDLINE | ID: mdl-35164259

RESUMEN

The use of natural products as therapeutic agents is rapidly growing recently. In the current study, we investigated the protective effects of green tea supplementation on lead-induced toxicity in mice. Forty albino mice were divided into four groups as follows: A: control group; B: green tea receiving group; C: lead-intoxicated group; and D: lead-intoxicated group supplemented with green tea. At the end of the experiment, the animals were tested for neurobehavioral and biochemical alterations. Green tea was analyzed through Gas Chromatography-Mass Spectrometry (GC/MS) analysis. We found that supplementation with green tea ameliorated the lead-associated increase in body weight and blood glucose. Green tea supplementation also changed the blood picture that was affected due to lead toxicity and ameliorated lead-induced dyslipidemia. The group of mice that were supplemented with green tea has shown positive alterations in locomotory, anxiety, memory, and learning behaviors. The GC/MS analysis revealed many active ingredients among which the two most abundant were caffeine and 1,2-benzenedicarboxylic acid, mono(2-ethylhexyl) ester. We concluded that green tea supplementation has several positive effects on the lead-induced neurotoxicity in mice and that these effects may be attributed to its main two active ingredients.


Asunto(s)
Intoxicación del Sistema Nervioso por Plomo/prevención & control , Plomo/toxicidad , , Animales , Conducta Animal/efectos de los fármacos , Glucemia/metabolismo , Peso Corporal/efectos de los fármacos , Encéfalo/metabolismo , Dislipidemias/inducido químicamente , Dislipidemias/prevención & control , Cromatografía de Gases y Espectrometría de Masas/métodos , Plomo/sangre , Plomo/metabolismo , Ratones
18.
Biomed Pharmacother ; 146: 112594, 2022 Feb.
Artículo en Inglés | MEDLINE | ID: mdl-34968927

RESUMEN

This study evaluated if the hepatic protective effect of Isoliquiritigenin (ISL) against doxorubicin (DOX)-treated rats involves upregulating sirtuin-1 (SIRT1) signaling. Adult male was divides into 5 groups (n = 6 rats/each) as control (vehicle), ISL (25 mg/kg), DOX (15 mg/kg), DOX + ISL, and DOX + ISL + EX-527 (a SIRT1 inhibitor, 5 mg/kg). ISL and EX-527 were administered 10 days before and after the single treatment of DOX. Also, cultured AML-12 hepatocytes (5 ×104) were treated with 10 µM of ISL for 24 h with or without DOX-treatments (10 µM) and in the presence or absence of EX-527 (5 µM). ISL prevented hepatocyte damage and decreased serum levels of hepatic transaminases, hepatic levels of tumor necrosis factor-α (TNF-α) and interleukin-6 (IL-6), and hepatic mRNA levels of Bax and caspases-3,8, and 9. In the liver of the control and DOX-treated rats, ISL reduced levels of malondialdehyde (MDA) but increased hepatic levels of glutathione (GSH), superoxide dismutase (SOD), and catalase, as well as mRNA levels of Bcl2. In vitro, ISL stimulated cell survival and lowered levels of ROS but increased GSH levels. In vivo and in vitro, in the livers of control and DOX-treated animals, ISL significantly increased the nuclear activity and mRNA levels of SIRT1, enhanced the nuclear levels of Nrf2, and reduced nuclear levels of NF-κB p65. In conclusion, ISL alleviates DOX-induced hepatocyte toxicity by stimulating the Nrf2/antioxidants axis and concomitant suppression of NF-κB, mainly by upregulating/activating SIRT1.


Asunto(s)
Chalconas/farmacología , Enfermedad Hepática Inducida por Sustancias y Drogas/prevención & control , Sirtuina 1/efectos de los fármacos , Animales , Apoptosis/efectos de los fármacos , Doxorrubicina/farmacología , Mediadores de Inflamación/metabolismo , Masculino , Factor 2 Relacionado con NF-E2/efectos de los fármacos , FN-kappa B/efectos de los fármacos , Estrés Oxidativo/efectos de los fármacos , Distribución Aleatoria , Ratas
19.
ACS Omega ; 6(47): 31982-31992, 2021 Nov 30.
Artículo en Inglés | MEDLINE | ID: mdl-34870021

RESUMEN

Clinoptilolite as a natural zeolite was integrated with green CaO nanoparticles forming the green nanocomposite CaO(NP)/Clino. The CaO(NP)/Clino composite was assessed as a potential carrier for 5-fluorouracil (5-FL) drug. The CaO(NP)/Clino carrier achieved an enhanced 5-FL loading capacity of 305.3 mg/g as compared to 163 mg/g for pure clinoptilolite. The kinetics of the 5-FL loading follow the properties of the pseudo-first-order model, while the equilibrium results are related to the Langmuir isotherm. Therefore, the 5-FL loading processes occurred in the monolayer formed by homogeneous active loading receptors on the surface of the CaO(NP)/Clino carrier. The Gaussian energy of the 5-FL loading reaction (9.2 KJ/mol) reflected the dominant effect for the chemical mechanisms, especially the zeolitic ion-exchange mechanisms. Additionally, the thermodynamic parameters suggested endothermic, feasible, and spontaneous properties for the occurred 5-FL loading reactions. The release profile of 5-FL from CaO(NP)/Clino has continuous and long properties (150 h) at pH 1.2 (gastric fluid) and pH 7.4 (intestinal fluid). The kinetic studies of the release reactions show considerable agreement with Higuchi, Hixson-Crowell, and Korsmeyer-Peppas models. Such high fitting results and the diffusion exponent values (0.49 at pH 1.2 and 0.48 at pH 7.4) reflected the release properties of the Fickian transport behavior involving complex erosion and diffusion mechanisms. The cytotoxicity study of CaO(NP)/Clino on colorectal normal cells (CCD-18Co) declare the safe and biocompatible effect as a carrier for the 5-FL drug. Additionally, CaO(NP)/Clino as a carrier causes considerable enhancement for the cytotoxic effect of the loaded 5-FL drug on colon cancer cells (HCT-116).

20.
Environ Sci Pollut Res Int ; 28(24): 31301-31311, 2021 Jun.
Artículo en Inglés | MEDLINE | ID: mdl-33599933

RESUMEN

Benzophenone-3 (BP-3) is used in a wide range of personal care products and plastics to resist ultraviolet light, which has aroused considerable public concern due to its endocrine-disrupting effects. In this work, we systematically investigated the chemical oxidation process of BP-3 by KMnO4. The influences of several factors, such as pH, oxidant dose, temperature, coexisting water constituents, and water matrices, on BP-3 degradation efficiency were evaluated. The removal rate of 10 µM BP-3 could reach 91.3% in 2 h under the conditions of pH = 8.0, [BP-3]0:[KMnO4]0 = 1:20, and T = 25 °C, with the observed rate constant (kobs) value of 0.0202 min-1. The presence of typical anions (Cl-, NO3-, SO42-) and HA could slightly increase BP-3 removal, while HCO3- caused a relatively significant promotion of BP-3 degradation. On the basis of mass spectrometry and theoretical calculations, hydroxylation, direct oxidation, and carbon-carbon bridge bond cleavage were mainly involved in the oxidation process. Toxicity assessment revealed that the acute and chronic toxicities were reduced significantly, which suggested KMnO4 is a promising technique for BP-3 removal.


Asunto(s)
Contaminantes Químicos del Agua , Purificación del Agua , Benzofenonas , Cinética , Oxidación-Reducción , Permanganato de Potasio , Rayos Ultravioleta , Agua , Contaminantes Químicos del Agua/análisis
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