Synchronous Fluorescence Spectroscopy Research Articles

Insights into interaction of triazine herbicides with three kinds of different alkyl groups (simetryne, ametryn and terbutryn) with human serum albumin via multi-spectral analysis

In this study, the interaction of triazine herbicides with three kinds of different alkyl groups (simetryne, ametryn and terbutryn) with human serum albumin (HSA) are investigated through UV–vis, fluorescence, and circular dichroism (CD) spectra. The mechanisms on the fluorescence quenching of HSA initiated by triazine herbicides are obtained using Stern-Volmer, Lineweaver-Burk and Double logarithm equations. The quenching rate constant (Kq), Stern-Volmer quenching constant (Ksv), binding constant (KA), thermodynamic parameters such as enthalpy change (∆H), entropy change (∆S) and Gibbs free energy (∆G) and number of binding site (n) are calculated and compared. The variations in the microenvironment of amino acid residues are studied by synchronous fluorescence spectroscopy. The binding sites and subdomains are identified using warfarin and ibuprofen as site probes. The conformational changes of HSA are measured using CD spectra. The results reveal that the triazine herbicides with different alkyl groups can interact with HSA by static quenching. The combination of the three herbicides and HSA are equally proportional, and the binding processes are spontaneous. Hydrophobic interaction forces play important roles in simetryne-HSA and ametryn-HSA, while the interaction of terbutryn-HSA is Van der Waals forces and hydrogen bonding. Moreover, the three herbicides can bind to HSA at site I (sub-domain IIA) more than site II (subdomain IIIA), and combine with tryptophan (Trp) more easily than tyrosine (Tyr) residues, respectively. By comparison, the order of interaction strength is terbutryn-HSA > ametryn-HSA > simetryne-HSA. Terbutryn can destroy the secondary structure of HSA more than simetryne and ametryn, and the potential toxicity of terbutryn is higher. It is expected that the interactions of triazine herbicides with HSA via multi-spectral analysis can offer some valuable information for studying the toxicity and the harm of triazine herbicides on human health at molecular level in life science.

The interaction between troxerutin and pepsin was studied by multispectral method and molecular docking simulation

The mechanism of action and quenching mode between troxerutin and pepsin were investigated in this study using ultraviolet-visible absorption spectroscopy, Fourier transform infrared spectroscopy, fluorescence spectroscopy, three-dimensional fluorescence spectroscopy, synchronous fluorescence spectroscopy, circular binary chromatography, and molecular docking simulation. The fluorescence spectroscopy results demonstrated a reduction in the fluorescence intensity of pepsin upon addition of troxerutin, indicating its quenching effect on pepsin. By employing the Stern-Volmer equation to determine KSV and Kq values, it can be inferred that troxerutin exhibits static quenching as the predominant mode of interaction with pepsin. By conducting experiments, the binding constant KA and the number of binding sites n for troxerutin and pepsin were determined, with the number of binding sites n being close to 1, indicating the presence of a specific binding site between troxerutin and pepsin. Thermodynamic analysis was employed to calculate the thermodynamic parameters at 298 K. The negative values of ΔH and ΔS suggest that van der Waals forces and hydrogen bonding are predominant in mediating the interaction between troxerutin and pepsin. The negativity of ΔG indicates the spontaneity of the reaction. The results of molecular docking simulations demonstrate that troxerutin binds to the central active region of pepsin, with hydrogen bonds, van der Waals forces, hydrophobic interactions and adverse collisions contributing to the binding forces between troxerutin and pepsin. Based on the analysis of UV–vis absorption spectrum, three-dimensional fluorescence spectrum, synchronous fluorescence spectrum, and infrared spectrum, it is evident that troxerutin modulates the microenvironment surrounding tryptophan amino acid residues in pepsin. This modulation leads to a reduction in polarity and hydrophilicity while increasing hydrophobicity, consequently inducing alterations in the secondary structure of pepsin. By measuring the binding distance, it is calculated that 0.5 R0 < r < 1.5 R0 and r < 7 nm, indicating the occurrence of non-radiative energy transfer between troxerutin and pepsin. Analysis of the circular dichroism spectrum confirms that pepsin predominantly adopts a β-folded (β-sheet) conformation, providing evidence for the interaction between troxerutin and pepsin. Furthermore, troxerutin induces alterations in the microenvironment of pepsin's structure, ultimately resulting in changes to its secondary structure. These findings shed light on the binding mechanism underlying troxerutin and pepsin interactions while offering valuable reference data for future research and applications involving troxerutin.

Interaction and Binding Kinetics of Different Substituted Pyrazines with HSA: Based on Multispectral, Physiological Activity, and Molecular Dynamics Simulations

Pyrazine is a kind of compound containing pyrazine ring structure, which has attracted the attention of researchers because of its special aroma and healthcare function. It is currently used in spices, pharmaceuticals, food additives, and other industries. Human serum albumin (HSA) is a transport and storage protein in the human circulatory system. Previous research reported that pyrazine can interact with albumin, but the interaction between pyrazine and HSA has not been reported. Consequently, this study is based on the multispectral method and molecular dynamics (MD) simulation, exploring the interaction between different pyrazines and HSA. The results show that the four pyrazines mainly quench the endogenous fluorescence of HSA through the static quenching mechanism. Molecular docking indicates that hydrophobic forces play a major role in the binding of pyrazines with HSA. At the same time, synchronous fluorescence spectroscopy, circular dichroism (CD), three-dimensional fluorescence spectroscopy, and resonance light scattering (RLS) showed that each pyrazine compound can change the conformation of HSA. MD simulation results show that the combination of four pyrazines and HSA can enhance the stability of HSA. Among them, 2,3,5,6-tetramethylpyrazine (TTMP) and 2,3,5-trimethylpyrazine (TMTP) binding is the most stable and the most unstable combination with HSA, respectively. In addition, the four pyrazines could affect the physiological activity of HSA. This study is of great significance to explore the mechanism of action of pyrazine compounds in vivo and can provide useful information for the application of pyrazine compounds in food.

A novel derivative synchronous fluorescence method for the rapid, non-destructive and intuitive differentiation of denitrifying bacteria

It is challenging to differentiate bacteria residing in the same habitat by direct observation. This difficulty impedes the harvest, application and manipulation of functional bacteria in environmental engineering. In this study, we developed a novel method for rapid differentiation of living denitrifying bacteria based on derivative synchronous fluorescence spectroscopy, as exemplified by three heterotrophic nitrification-aerobic denitrification bacteria having the maximum nitrogen removal efficiencies greater than 90%. The intact bacteria and their living surroundings can be analyzed as an integrated target, which eliminates the need for the complex pre-processing of samples. Under the optimal synchronous scanning parameter (Δλ = 40 nm), each bacterium possesses a unique fluorescence spectral structure and the derivative synchronous fluorescence technique can significantly improve the spectral resolution compared to other conventional fluorescence methods, which enables the rapid differentiation of different bacteria through derivative synchronous fluorescence spectra as fast as 2 min per spectrum. Additionally, the derivative synchronous fluorescence technique can extract the spectral signals contributed by bacterial extracellular substances produced in the biological nitrogen removal process. Moreover, the results obtained from our method can reflect the real-time denitrification properties of bacteria in the biological nitrogen removal process of wastewater. All these merits highlight derivative synchronous fluorescence spectroscopy as a promising analytic method in the environmental field.

A ratiometric fluorescent probe with 1,2,4-triazole recognition unit for fluoride ion detection based on synchronous fluorescence spectroscopy

As an important inorganic chemical with wide applications and high toxicity, the detection of fluoride-containing products and environmental samples has gained the most interest. In this work, a ratiometric fluorescent probe (NIN2) is constructed with a triazole group as the new recognition site for the detection of F−. The synchronous fluorescence technology was introduced to obtain the well discrimination of two emission bands. The value of wavelength intervals (Δλ = λem. - λex.) is optimized to be set as 70 nm with the minimized overlap of two emission bands centered around 380 nm and 470 nm, respectively. In this way, NIN2 can detect F− in the region of 0–0.2 μM with a good linear relationship (R2 = 0.9989) and low LOD value (36 nM). Only F− can induce obvious ratiometric response (I470nm/I380nm) from 0.2 to 3.4 while the ratios of the samples containing other cations and anions are as low as the blank sample. For investigating the recognition mechanism of triazole, 1H, 13C and 19F NMR spectral technologies were used to verify the interaction between triazole and F−. Furthermore, the DFT calculation was also performed to discuss the electronic transition of NIN2 before and after interaction with F−. We believe this work provides a new recognition moiety for detecting F−.

Investigating the binding interaction of quinoline yellow with bovine serum albumin and anti-amyloidogenic behavior of ferulic acid on QY-induced BSA fibrils

Protein aggregation induces profound changes in the structure along with the conformation of the protein, and is responsible for the pathogenesis of a number of neurodegenerative conditions such as Huntington’s, Creutzfeldt–Jacob, Type II diabetes mellitus, Alzheimer’s, etc. Numerous multi-spectroscopic approaches and in-silico experiments were utilized to investigate BSA’s biomolecular interaction and aggregation in the presence of quinoline yellow. The present research investigation evaluated the interaction of BSA with the food colorant (QY) at two different pH (7.4 and 2.0). The development of the BSA-QY complex was established with UV visible and fluorescence spectroscopy. The quenching of fluorescence upon the interaction of BSA with QY revealed the static nature of quenching mechanism. The Kb value obtained from our result is 4. 54 × 10−4 M−1. The results from the competitive site marker study infer that quinoline yellow is binding with the sub-domain IB of bovine serum albumin, specifically on site III. Three-dimensional fluorescence and synchronous fluorescence spectroscopy were applied for monitoring the alterations in the microenvironment of BSA upon the addition of quinoline yellow. The results from turbidity and RLS studies showed that higher concentrations of QY (80–400 µM) triggered bovine serum albumin (BSA) aggregation at pH 2.0. At pH 7.4, QY couldn’t manage to trigger bovine serum albumin aggregation, perhaps because of the repulsion between negatively charged dye (QY) and anionic bovine serum albumin. The results from far-UV CD, Congo Red, and scanning electron microscopy implicate that the QY-induced aggregates exhibit amyloid fibril-like structures. Molecular docking results revealed that hydrophobic interactions, hydrogen bonding, and Pi-Sulfur interactions contribute to QY-induced aggregation of BSA. Further, the amyloid inhibitory potential of ferulic acid (FA), a phenolic acid on QY-induced aggregation of BSA, has also been assessed. The QY-induced amyloid fibrils are FA-soluble, as confirmed by turbidity, RLS, and far-UV CD studies. Far-UV CD results showed that FA retains α helix and inhibits cross β sheet formation when the BSA samples were pre-incubated with increasing concentrations of FA (0–500 µM). Our findings conclude that QY dye successfully stimulates BSA aggregation, but ferulic acid inhibits QY-induced aggregation of BSA. Thus, FA can serve as a therapeutic agent and can help in the treatment of various amyloid-related conditions.

Applying synchronous fluorescence with Gaussian band fitting and MW-2DCOS to assess removals of DOM in acrylic fiber wastewater treatment process

Acrylic fiber wastewater (AFW) with hypertoxicity and recalcitrant are treated by advanced oxidation biological techniques. Some water quality parameters as online indicators to monitor pollutant removals, fail to trace removals of organic pollutants. Hence a practicable tool is indispensable for insight into removals of organic pollutants. Synchronous fluorescence spectroscopy (SFS) combined with Gaussian band fitting and two-dimensional correlation spectroscopy (2D-COS) was developed to evaluate removals of dissolved organic matter (DOM) fractions in an AFW treatment plant. Five fluorescence components were identified from DOM by SFS with principal component analysis and Gaussian band fitting, i.e., low-molecular-weight (LMWF1 and LMWF2), microbial humic-like (MHLF) and high-molecular-weight substances (HMWF1 and HMWF2). LMWF2 and HMWF2 were the representative components (52.96%) in the AFW, whose removal efficiencies (94.05% and 73.11%) were much higher than those of LMWF1 (40.16%) and HMWF1 (17.45%). Nitriles and amides occurred in LMWF2, whereas the aromatics in four DOM fractions. Based on 2D-COS, the changing order of DOM fractions was MHLF→ HMWF1→ nitriles→ LMWF2→ HMWF2→ amides→ LMWF1→ aromatics. The nitriles and HMWF1 were continuously removed in treatment process. LMWF2 was degraded by anaerobic and nitrifying bacteria, while the degradation of amides and HMWF2 by anaerobic and aerobic microorganisms. Furthermore, the nitriles could reduce microbial activities, which was mainly removed with the degradation of LMWF2. SFS combined with Gaussian band fitting and 2D-COS could be an applicable approach to monitor variations of DOM fractions and evaluate its removals in the AFW. These findings could be conducive to developing an online equipment in WWTP.

A novel synchronous fluorescence spectrometry combined with fluorescence sensitization for the highly sensitive and simultaneous detection of enoxacin, ofloxacin and tetracycline hydrochloride residues in wastewater

The synergistic effect of sodium dodecyl sulfate (SDS) and Mg2+ could significantly enhance the fluorescence intensity of enoxacin (ENO) at λex/λem = 269.2 nm/385.6 nm, ofloxacin (OFL) at λex/λem = 290.8 nm/466.2 nm and tetracycline hydrochloride (TCH) at λex/λem = 372.6 nm/514.8 nm. Moreover, when the wavelength difference (Δλ) was chosen 135 nm, the synchronous fluorescence spectra of the three antibiotic complexes could be well separated and the interference of the samples matrix were eliminated primely. Therefore, only one synchronous fluorescence scan was needed to simultaneously determine the three antibiotics. Based on these facts, a synchronous fluorescence spectrometry combining fluorescence sensitization for highly sensitive and selective determination of ENO, OFL and TCH residues in wastewater was developed for the first time. The experimental results showed that the concentrations of ENO, OFL and TCH in the range of 0.5–550 ng mL−1, 1–1500 ng mL−1 and 10–5500 ng mL−1 showed a good linear relationship with fluorescence intensity. The limits of detection were 0.0599 ng mL−1, 0.115 ng mL−1 and 0.151 ng mL−1, respectively. The recoveries of the actual sample were 87.50%–99.99 %, 93.00%–98.50 % and 85.70%–98.42 %, respectively. Overall, the novel synchronous fluorescence spectrometry established in the experiment has the advantages of high sensitivity, good selectivity, fast detection speed and high accuracy. It has been successfully applied to the detection of residual amounts of ENO, OFL and TCH in wastewater with satisfactory results.

Simultaneous and rapid determination of lomefloxacin and chlortetracycline hydrochloride residues in meat foods by Al3+ sensitized synchronous fluorescence spectrometry

The fluorescence intensity of lomefloxacin and chlortetracycline hydrochloride were significantly enhanced after the complexation of the two antibiotics with Al3+ and the synchronous fluorescence spectra of the two complexes could be well separated when Δλ = 70 nm. Based on the above facts, a new method combining Al3+ sensitization with synchronous fluorescence spectrometry was developed to determine lomefloxacin and chlortetracycline hydrochloride residues in meat foods in this study. This study showed that the concentration of the two antibiotics had an excellent linear relationship with the synchronous fluorescence intensity in the range of 1–550 ng mL−1 and 5–1800 ng mL−1. Detection limits of the two antibiotics were 0.0378 μg kg−1 and 0.3530 μg kg−1, respectively. Recovery rates for lomefloxacin and chlortetracycline hydrochloride were 86.1 - 90.2% and 85.3 - 96.5% in meat samples, respectively. The novel synchronous fluorescence spectrometry established in the experiment had the advantages of high sensitivity, good selectivity, low detection limit, fast detection speed and high accuracy. It had been applied to the detection of lomefloxacin and chlortetracycline hydrochloride residues in meat with satisfactory results.

Interaction of food colorant indigo carmine with human and bovine serum albumins: A multispectroscopic, calorimetric, and theoretical investigation

In this work we have studied the interaction of the food dye Indigo-Carmine (IndC) with the most studied model transport proteins i.e. human and bovine serum albumin (HSA & BSA). A multispectroscopic approach was used to analyze the details of the binding process. The intrinsic fluorescence of both the albumins was significantly quenched by IndC and the quenching was both static and dynamic in nature with the former being dominant. The HSA-lndC and BSA-IndC distance after complexation was determined by Förster resonance energy transfer (FRET) method which suggested efficient energy transfer from the albumins to IndC. Thermodynamics of serum protein-IndC complexation was estimated by isothermal titration calorimetry (ITC) which revealed that the binding was enthalpy driven. Circular dichroism (CD) and FTIR spectroscopy revealed that the binding of IndC induced secondary structural changes in both the serum proteins. Synchronous and 3D fluorescence spectroscopy revealed that the binding interaction caused microenvironmental changes of protein fluorophores. Molecular docking analysis suggested that hydrogen bonding and hydrophobic interactions are the major forces involved in the complexation process.

Investigation of the interaction between S-isoalkyl derivatives of the thiosalicylic acid and human serum albumin

S-isoalkyl derivatives of thiosalicylic acid (isopropyl-(L1), isobutyl-(L2) and isoamyl-(L3)) were selected in order to investigate the binding interaction with the human serum albumin (HSA) using different spectroscopic methods and molecular docking simulation. Association constants and number of binding sites were used to analyze the quenching mechanism. The experimental results showed that the fluorescence quenching of HSA by L1, L2 and L3 occurs because of static quenching and that binding processes were spontaneous, with the leading forces in bonding by hydrogen bonding, hydrophobic interactions, and electrostatic interactions. Fluorescence spectroscopy, UV-Vis spectroscopy and synchronous fluorescence spectroscopy showed that ligands (L1, L2 and L3) can bind to HSA and that the binding of ligands induced some microenvironmental and conformational changes in HSA. The calculated distance between the donor and the acceptor according to fiFörster’s theory confirms the energy transfer efficiency between the acceptor and HSA. Results of site marker competitive experiments showed that the tested compounds bind to HSA in domain IIA (Site I). Molecular dynamics and docking calculations demonstrated that L3 binds to the Sudlow site I of HSA with lower values of binding energies compared to L1 and L2, indicating the formation of the most stable ligand-HSA complex. Understanding the binding mechanisms of S-isoalkyl derivatives of the thiosalicylic acid to HSA may provide valuable data for the future studies of their biological activity and application as potential antitumor drugs. Communicated by Ramaswamy H. Sarma

Identification and Limit of Detection of Benzene, Chlorobenzene, Benzoic Acid, Phthalic Acid, and Mellitic Acid in Water Solutions Using Excitation, Emission, and Single-band Synchronous Fluorescence Spectroscopy

Introduction: This paper first introduces the use of computer-simulated single-band synchronous fluorescence (SF) obtained from experimental excitation and emission fluorescence spectra of a pure compound in solution. The simulation produces a single narrow band with a peak wavelength that identifies the compound. Methods: The method is used to show single peak identification of benzene, chlorobenzene, benzoic acid, phthalic acid, and mellitic acid in water solutions. Synchronous fluorescence spectroscopy (SFS) is a variant of fluorescence technique in which excitation and emission scans are simultaneously acquired and multiplied with a predetermined wavelength difference (Δλ) between the two. Commercial instruments have this option to get the SFS signals. Results: In response to the Δλ selected, the result will be an SFS signal producing a series of peaks that could be assigned to compounds. Instead of running the same experiment with different Δλ values to identify the compounds, our simulation program determines a specific Δλ value that generates a narrow SF band with a distinctive peak wavelength for identification purposes. Conclusion: Finally, binary mixtures of chlorobenzene with each compound in water are prepared. The SFS of the solution is acquired and compared with the SFS bands of the components for identification purposes. With the commercial lamp fluorimeter employed, the limits of detection are obtained at the ng/g concentration level with fluorescence emission. Possible limits of detection at lower concentrations are discussed using a laser source. The presence of these molecules in astrochemical studies is discussed.

A synchronous-fluorescence analysis method combing with simple one-step extraction for determination of leonurine in traditional Chinese medicine.

Synchronous fluorescence spectroscopy (SFS) technology exhibits significant advantages in identifying target fluorescence signals within complex mixtures of multiple fluorescent compounds, owing to their closely overlapping spectra. In this study, a SFS method is reported for the first time for the direct analysis of leonurine in drugs containing concurrent natural products. By setting the wavelength interval (Δλ) to 30 nm, the characteristic emission peak of leonurine is observed at 307 nm, which increases proportionally with the concentration of leonurine without spectral overlap from other fluorescent species. The limit of detection (LOD) is estimated to be about 0.22 μM, and a low linear range of 0 to 20 μM is obtained. The common cations, anions and concomitant compounds display no interference with the SFS signal of leonurine, supporting the practical application of this method. Thus, we successfully applied this SFS method to detect leonurine in several real samples (leonurus granules, capsules, ointment and pills), in which the good relative standard deviation (RSD) values (0.04-4.24%) and recoveries (95.63-113%) were obtained. As a result, this work provides an efficient and convenient method to identify the target active compound from natural products without complex pre-treatment to diminish the fluorescent chaos that might be serving a potential role in the study of traditional Chinese medicine.

Combining a tunable pinhole with synchronous fluorescence spectrometry for visualization and quantification of benzo[a]pyrene at the root epidermis microstructure of Kandelia obovata.

The adsorption of polycyclic aromatic hydrocarbons (PAHs) by mangrove roots and their transport to chloroplasts is a potentially critical process that reduces the carbon sequestration efficiency of mangroves. Yet the crucial initial step, the distribution and retention of PAHs at the root epidermis microstructure, remains unclear. A novel method with a spatial resolution of 311 nm was developed for visualizing and quantifying benzo[a]pyrene (B[a]P) at the root epidermis microstructure (0.096 mm2) of Kandelia obovata (Ko). This method combined a tunable pinhole in laser confocal scanning microscopy with synchronous fluorescence spectrometry to reduce the auto-fluorescence interference in locating B[a]P and improve quantitative sensitivity. The linear range for the established method was 0.44-50.00 ng mm-2, with a detection limit of 0.063 ng mm-2 and a relative standard deviation of 9.45%. In a 60-day hydroponic experiment, B[a]P was primarily adsorbed along the epidermis cell walls of secondary lateral roots and lateral roots, with retained amounts of 0.65 ng mm-2 and 0.49 ng mm-2, respectively. It was found to cluster and predominantly accumulate at the epidermal cell surfaces of taproots (0.24 ng mm-2). B[a]P might enter inner root tissues through the root epidermal cell walls and surfaces of Ko, with the cell walls potentially being the main route. This study potentially provides a pathway for visualizing and quantifying B[a]P entering inner root tissues of mangroves.

Unravelling molecular interaction of the uranyl(VI) complex with bovine serum albumin.

Interest in the biotoxicology of uranium resulting from its inherent radioactive as well as chemical properties has been growing intensely in recent years. Indeed, uranium in its stable form as UO22+ species is ubiquitously found on earth, and this form is commonly known as the uranyl(VI) ion. The unusual electronic environment at the core of the uranyl(VI) complex plays an important role in its interaction with biomacromolecules. Based on the spectroscopic and computational studies, we have explored the interaction of the uranyl(VI) complex with BSA. The results showed that the fluorescence intensity of BSA was quenched upon interaction with the uranyl(VI) complex largely through dynamic mode, which was authenticated by Stern-Volmer calculations and fluorescence lifetime measurements at different temperatures. Fluorescence anisotropy and synchronous fluorescence spectroscopy were performed to understand the micro-environments of the fluorophores. Furthermore, the binding constant, standard free energy and number of binding sites were also calculated. Thermodynamic parameters such as ΔH° and ΔS° revealed that the non-covalent interactions played a principal role in the binding of the uranyl(VI) complex to BSA, and the value of ΔG° indicated the spontaneity of the interaction. Using the site marker fluorescent probes, the binding location of the uranyl(VI) complex at the BSA site was established. This was further supported by the molecular docking technique with a docking free energy of -38.91 kJ mol-1, indicating the non-covalent binding of the uranyl(VI) complex with BSA active sites. This piece of work may contribute mostly to understanding the pharmacokinetics of the uranyl(VI) complex and provide fundamental data on its safe usage.

同步荧光光谱研究头孢匹林钠与牛血清白蛋白相互作用机制

同步荧光光谱研究头孢匹林钠与牛血清白蛋白相互作用机制

Enhanced Detection of Benzo[a]pyrene in Olive Oil through Low Temperature Liquid-Liquid Extraction Coupled with Constant Energy Synchronous Fluorescence Spectroscopy

Refined processed olive oil can indeed become significantly contaminated with polycyclic aromatic hydrocarbons (PAHs). To assess exposure to these contaminants, benzo[a]pyrene (B[a]P) is utilized as a marker due to its known carcinogenicity in humans. The European Commission has established a maximum limit of 2 μg kg-1 for B[a]P in edible oils. However, the analysis of trace amounts of B[a]P in a complex matrix like olive oil poses a persistent challenge. In this study, we have developed a low-temperature liquid-liquid extraction method in combination with constant energy synchronous fluorescence analysis for the determination of B[a]P in olive oil samples. The analyte was extracted from the olive oil using a mixture of acetonitrile and acetone. The performance of fluorescence measurements was evaluated by carefully considering the effects of solvent, temperature, acetone quenching, and slit width for monochromators. The proposed method demonstrates a linear range from 0.8 to 3.2 μg kg-1, with limits of detection and quantification of 0.04 and 0.80 μg kg-1, respectively. Precision and trueness assessments revealed relative standard deviations of less than 10% and recovery rates ranging from 103 to 112%. This method presents an efficient and rapid alternative to sample preparation procedure that minimizes organic solvent consumption.

Synchronous Fluorescence Spectroscopy Method based on Chemometrics: Authentication of Extra Virgin Olive Oils Harvested in Mut (Mersin) Region and Refined Edible Oils

Bu çalışma, Mut (Mersin) bölgesinden iki farklı hasat döneminde (2019 ve 2020 Ekim) elde edilen ekstra saf sızma zeytinyağı (VOO) ve farklı markalara ait rafine yemeklik yağ numunelerinde tağşiş/sahtecilik durumu hakkında fikir edinmeyi amaçlamaktadır. Araştırmayı gerçekleştirmek için senkron floresans (SyF) spektroskopisine dayalı analitik yaklaşım, PCA ve SIMCA kemometrik veri analiz yöntemi ile kullanılmıştır. SyF verileri 200–800 nm emisyon bölgesinde elde edilmiş ve uyarma/emisyon monokromatörleri senkronize şekilde kullanılmıştır. Saf VOO ve farklı türdeki yağ numuneleri için elde edilen veriler; PCA ve SIMCA çok değişkenli veri modellemeleri ile analiz edilmiştir. Elde edilen PCA skor grafiklerinde; yağ türlerinin ve farklı hasat zamanlarına ait zeytinyağı örneklerinin sınıflandırma yeteneğinin oldukça yüksek olduğu; SIMCA modellemelerinde ise VOO numunelerinin diğer yağ türlerinden %100 farklı bir grupta sınıflandırılabildiği tespit edilmiştir. Sonuç olarak SyF spektroskopisi kemometrik analiz yöntemleri ile birleştirildiğinde hız ve maliyet açısından oldukça avantajlı bir yöntem olup, zahmetli numune ön işlemleri ve kimyasal kullanımını ortadan kaldırarak büyük kolaylık sağlamaktadır.

Eco-friendly novel deconvoluted synchronous spectrofluorimetric approach for the determination of favipiravir, levodropropizine and moxifloxacin hydrochloride as an effective therapeutic combination for COVID-19; application in laboratory prepared mixtures and spiked human plasma

In this work, a green, fast, and simple synchronous spectrofluorimetric approach has been developed to simultaneously determine favipiravir, levodropropizine, and moxifloxacin hydrochloride as co-administered medications for COVID-19 treatment in pure form and spiked human plasma. The synchronous fluorescence spectroscopy technique to analyze the studied drugs at Δλ = 110 nm enabled the determination of levodropropizine at 360 nm. Then, applying Fourier Self-Deconvolution to each spectra to measure favipiravir and moxifloxacin hydrochloride at peak amplitudes of 431 nm and 479 nm, respectively, without any interference. Favipiravir, levodropropizine, and moxifloxacin hydrochloride could be sensitively determined using the described approach over concentration ranges of 20–300 ng/mL, 10–600 ng/mL, and 50–500 ng/mL, respectively. The method's validation was carried out effectively in accordance with guidelines recommended by the ICH. Finally, the Eco-scale and Green Analytical Procedure Index (GAPI) techniques have been used to evaluate the greenness of the proposed method.

Interaction Mechanism of Hesperidin and L-Tryptophan: A Experimental and Molecular Docking Studies

The binding of L-tryptophan (L-Trp) and hesperidin (HES) was investigated by UV, fluorescence, synchronous fluorescence, time-resolved fluorescence, Fourier transform infrared (FTIR) spectroscopies, FRET, antibacterial activity, anticancer activity and molecular docking study. The flavonoid glycoside known as hesperidin has been shown to have therapeutic properties for a variety of disorders, including cancer diseases. Its low solubility and bioavailability cause it to be little absorbed, which means that a delivery mechanism is necessary in order for it to reach its therapeutic goal. Fluorescence data revealed that the fluorescence quenching mechanisms of L Trp by hesperidin are all static quenching procedures. Synchronous fluorescence spectroscopy shows the interaction between hesperidin and L-Trp changes the hydrophobicity of the microenvironment of tryptophan (Trp) residues. The anticancer activity effect of hesperidin and L-Trp on human cervical cancer cell lines was assessed using MTT and crystal violet assays.