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1.
Spectrochim Acta A Mol Biomol Spectrosc ; 316: 124325, 2024 Aug 05.
Article in English | MEDLINE | ID: mdl-38701574

ABSTRACT

A Schiff-base Ethyl (E)-2-(3-((2-carbamothioylhydrazono)methyl)-4-hydroxyphenyl)-4-methylthiazole-5-carboxylate (TZTS) dual functional colorimetric and photoluminescent chemosensor which includes thiazole and thiosemicarbazide has been synthesized to detect arsenic (As3+) ions selectively in DMSO: H2O (7:3, v/v) solvent system. The molecular structure of the probe was characterized via FT-IR, 1H, and 13C NMR & HRMS analysis. Interestingly, the probe exhibits a remarkable and specific colorimetric and photoluminescence response to As3+ ions when exposed to various metal cations. The absorption spectral changes of TZTS were observed upon the addition of As3+ ions, with a naked eye detectable color change from colorless to yellow color. Additionally, the chemosensor (TZTS) exhibited a new absorption band at 412 nm and emission enhancements in photoluminescence at 528 nm after adding As3+ ions. The limit of detection (LOD) for As3+ ions was calculated to be 16.5 and 7.19 × 10-9 M by the UV-visible and photoluminescent titration methods, respectively. The underlying mechanism and experimental observations have been comprehensively elucidated through techniques such as Job's plot, Benesi-Hildebrand studies, and density functional theory (DFT) calculations. For practical application, the efficient determination of As3+ ions were accomplished using a spike and recovery approach applied to real water samples. In addition, the developed probe was successfully employed in test strip applications, allowing for the naked-eye detection of arsenic ions. Moreover, fluorescence imaging experiments of As3+ ions in the breast cancer cell line (MCF-7) demonstrated their practical applications in biological systems. Consequently, these findings highlight the significant potential of the TZTS sensor for detecting As3+ ions in environmental analysis systems.


Subject(s)
Arsenic , Colorimetry , Density Functional Theory , Thiazoles , Colorimetry/methods , Humans , Thiazoles/chemistry , Thiazoles/analysis , Arsenic/analysis , Limit of Detection , MCF-7 Cells , Ions/analysis , Optical Imaging
2.
Chemosphere ; 358: 142244, 2024 Jun.
Article in English | MEDLINE | ID: mdl-38705411

ABSTRACT

Neonicotinoids are a class of broad-spectrum insecticides that are dominant in the world market. They are widely distributed in the environment. Understanding the sources, distribution, and fate of these contaminants is critical to mitigating their effects and maintaining the health of aquatic ecosystems. Contamination of surface and groundwater by neonicotinoids has become a widespread problem worldwide, requiring comprehensive action to accurately determine the mechanisms behind the migration of these pesticides, their properties, and their adverse effects on the environment. A new approach to risk analysis for groundwater intake contamination with emerging contaminants was proposed. It was conducted on the example of four neonicotinoids (acetamiprid, clothianidin, thiamethoxam, and imidacloprid) in relation to groundwater accessed by a hypothetical groundwater intake, based on data obtained in laboratory tests using a dynamic method (column experiments). The results of the risk analysis conducted have shown that in this case study the use of acetamiprid and thiamethoxam for agricultural purposes poses an acceptable risk, and does not pose a risk to the quality of groundwater extracted from the intake for food purposes. Consequently, it does not pose a risk to the health and life of humans and other organisms depending on that water. The opposite situation is observed for clothianidin and imidacloprid, which pose a higher risk of groundwater contamination. For higher maximum concentration of neonicotinoids used in the risk analysis, the concentration of clothianidin and imidacloprid in the groundwater intake significantly (from several to several hundred thousand times) exceeds the maximum permissible levels for drinking water (<0.1 µg/L). This risk exists even if the insecticides containing these pesticides are used according to the information sheet provided by the manufacturer (lower maximum concentration), which results in exceeding the maximum permissible levels for drinking water from several to several hundred times.


Subject(s)
Groundwater , Insecticides , Neonicotinoids , Water Pollutants, Chemical , Groundwater/chemistry , Neonicotinoids/analysis , Water Pollutants, Chemical/analysis , Insecticides/analysis , Risk Assessment , Environmental Monitoring , Thiamethoxam/analysis , Humans , Thiazoles/analysis , Guanidines/analysis , Drinking Water/chemistry , Nitro Compounds/analysis
3.
J Am Soc Mass Spectrom ; 35(5): 839-854, 2024 May 01.
Article in English | MEDLINE | ID: mdl-38587268

ABSTRACT

Personal care products (PCPs) are integral components of daily human existence, including a large number of chemicals intentionally added for functional attributes (e.g., preservatives and fragrances) or unintentionally present, such as plasticizers. This investigation aimed to optimize the methodology for target and suspect screening via liquid chromatography-high-resolution mass spectrometry, focusing on nine prevalent organic additives (comprising bisphenols A, F, and S, methyl, ethyl, propyl, and butylparaben, 5-chloro-2-methyl-4-isothiazolin-3-one, and 4-hydroxybenzoic acid). A total of 50 high-selling PCPs were purchased from the local online market as samples. In detail, PCP samples were classified into body washes, shampoos, hair conditioners, facial cleansers, body lotions, and moisture creams. For calibration, the quality assurance and quality control results demonstrated a coefficient of determination (R2) surpassing 0.999, with detection and quantification limits ranging from 2.5 to 100.0 ng/g. For recovery experiments, replicate recoveries (n = 5) ranged from 61 to 134%. In purchased PCP samples, five of the nine target compounds were detected via a target screening. Methylparaben exhibited the highest concentration (7860 mg/kg) in a facial cleanser, which is known as an endocrine-disrupting chemical. A total of 248 suspects of organic additives were screened in PCPs, leading to a tentative identification of 9. Confirmation (confidence level 1) via reference standards was achieved for three suspects, while six were tentatively identified with a confidence level of 2. This two-step extraction methodology utilizing methyl tert-butyl ether and isopropyl alcohol enabled simultaneous analysis of diverse chemical groups with distinct properties.


Subject(s)
Cosmetics , Parabens , Cosmetics/chemistry , Cosmetics/analysis , Parabens/analysis , Chromatography, Liquid/methods , Limit of Detection , Mass Spectrometry/methods , Phenols/analysis , Phenols/chemistry , Benzhydryl Compounds/analysis , Benzhydryl Compounds/chemistry , Thiazoles/analysis , Thiazoles/chemistry , Humans , Reproducibility of Results , Tandem Mass Spectrometry/methods
4.
Environ Toxicol Chem ; 43(5): 952-964, 2024 May.
Article in English | MEDLINE | ID: mdl-38517100

ABSTRACT

Pesticides, especially the newly developed neonicotinoids, are increasingly used in many countries around the world, including Cameroon, to control pests involved in crop destruction or disease transmission. Unfortunately, the pesticides also pose tremendous environmental problems because a predominant amount of their residues enter environmental matrices to affect other nontargeted species including humans. This therefore calls for continuous biomonitoring of these insecticides in human populations. The present study sought to assess the neonicotinoid insecticide exposures in two agrarian regions of Cameroon, the South-West region and Littoral region. The study involved 188 men, including 125 farmers and 63 nonfarmers. Spot urine samples were obtained from these subjects and subjected to liquid chromatographic-tandem mass spectrometric analysis for concentrations of neonicotinoid compounds, including acetamiprid, clothianidin, dinotefuran, imidacloprid, thiacloprid, nitenpyram, thiamethoxam, and N-dm-acetamiprid. Neonicotinoid compounds were detected in all study participants, and residues of all the screened pesticides were detected among participants. N-dm-Acetamiprid and imidacloprid were the most prevalent among the subjects (100.0% and 93.1%, respectively), whereas nitenpyram was less common (3.2%). The median values of imidacloprid and total urinary neonicotinoid concentrations were elevated among farmers (0.258 vs. 0.126 µg/L and 0.829 vs. 0.312 µg/L, respectively). Altogether the findings showed that both the farmer and nonfarmer study populations of Cameroon were exposed to multiple residues of neonicotinoids, with relatively higher levels of pesticides generally recorded among farmers. Although exposure levels of the neonicotinoids were generally lower than their respective reference doses, these results warrant further research on the health risk evaluation of multiple residues of the pesticides and reinforcement of control measures to minimize the exposure risks, especially among farmers. Environ Toxicol Chem 2024;43:952-964. © 2024 SETAC.


Subject(s)
Farmers , Neonicotinoids , Occupational Exposure , Thiazines , Humans , Male , Neonicotinoids/analysis , Neonicotinoids/urine , Occupational Exposure/analysis , Cameroon , Adult , Middle Aged , Nitro Compounds/analysis , Insecticides/analysis , Insecticides/urine , Young Adult , Thiazoles/analysis , Thiazoles/urine , Pesticides/analysis , Pesticides/urine , Guanidines/analysis , Guanidines/urine , Thiamethoxam , Environmental Monitoring
5.
Environ Pollut ; 343: 123186, 2024 Feb 15.
Article in English | MEDLINE | ID: mdl-38142029

ABSTRACT

The second-generation neonicotinoid thiamethoxam, is prevalent in soils because of its extensive application and persistence. However, the comprehensive effects of thiamethoxam residue in soils on cultivated plants are still poorly understood. This study examined variations of growth state, physiological parameters, antioxidant activity, and metabolites in lettuce after thiamethoxam exposure; the removal effects of different washing procedures were also investigated. The results indicated that thiamethoxam in soils significantly increased the fresh weight, seedling height and chlorophyll content in lettuce, and also altered its lipid, carbohydrate, nucleotide and amino acids composition based on untargeted metabolomics. KEGG pathway analysis uncovered a disruption of lipid pathways in lettuce exposed to both low and high concentrations of thiamethoxam treatments. In addition, the terminal residues of thiamethoxam in lettuce were below the corresponding maximum residue limits stipulated for China. The thiamethoxam removal rates achieved by common washing procedures in lettuce ranged from 26.9% to 42.6%. This study thus promotes the understanding of the potential food safety risk caused by residual thiamethoxam in soils.


Subject(s)
Insecticides , Lactuca , Thiamethoxam , Insecticides/analysis , Thiazoles/analysis , Neonicotinoids/toxicity , Neonicotinoids/chemistry , Soil/chemistry , Lipids
6.
Sci Total Environ ; 882: 163399, 2023 Jul 15.
Article in English | MEDLINE | ID: mdl-37061057

ABSTRACT

Neonicotinoid photodegradation is seldom considered in different vegetable leaves after spraying under climate warming. This study investigated the effect of elevated cultivated temperature from 15/10 °C to 21/16 °C on the photodegradation of dinotefuran, thiamethoxam, acetamiprid, and thiacloprid on four vegetable leaves under simulated sunlight irradiation. The photodegradation rates of neonicotinoids on spinach leaves were 1.1-1.6, 1.1-2.0, and 1.4-2.4 times higher than those on pak choi, Chinese cabbage, and radish leaves, respectively. The higher production concentrations of hydroxyl radicals (•OH) and superoxide radicals in spinach leaf wax may contribute to the fastest photodegradation among four vegetables. When the cultivated temperature increased from 15/10 °C to 21/16 °C, neonicotinoid photodegradation rates decreased by 1.4-2.8 times on the four vegetables. Elevated cultivated temperature decreased the polarity of wax, which reduced the contact probability of neonicotinoids with reactive species on vegetable leaves and photodegradation rates. A positive linear correlation was found between the content of CHCH groups in wax determining •OH generation and the neonicotinoid photodegradation rates on four vegetable leaves cultivated at three temperatures (R2 = 0.67-0.94). Insights into neonicotinoid photodegradation on edible vegetables under climate warming are of great significance for better evaluating human exposure to neonicotinoids through the dietary pathway.


Subject(s)
Insecticides , Vegetables , Humans , Insecticides/analysis , Photolysis , Thiazoles/analysis , Neonicotinoids , Nitro Compounds/analysis , Plant Leaves/chemistry
7.
Fitoterapia ; 162: 105282, 2022 Oct.
Article in English | MEDLINE | ID: mdl-35988845

ABSTRACT

BACKGROUND: The roots of horseradish (Armoracia rusticana) are used for infections of respiratory airway and for urinary tract infections due to isothiocyanates (ITC), enzymatically formed during fermentation of glucosinolates by myrosinase. HYPOTHESIS/PURPOSE: The present study aims to present a comprehensive overview on the phytochemical composition of A. rusticana roots, especially concerning isothiocyanates and respective glucosinolates. The complex flavonoid spectrum of the herbal material is reviewed. Published data on in vitro activity of horseradish extracts and isolated compounds are summarized. These data indicate well-established use of horseradish as an antibacterial remedy against bacterial infections of the airway and urinary tract. STUDY DESIGN: To answer the question if other compounds from A. rusticana beside ITC contribute to the antibacterial activity, non-targeted LC-MS studies were performed with fermented and non-fermented horseradish extracts, and detailed phytochemical profiles were established. RESULTS: Comparative investigations on the antibacterial activity indicated that only ITC-containing extracts and fractions exert antibacterial activity. The huge variety of non-ITC compounds do not significantly contribute to the antibacterial activity, but can be used for analytical characterisation and quality control of the herbal material. Detailed phytochemical analysis additionally revealed a variety of compounds, not described until now for horseradish roots: the flavonol glycosides kaempferol-3-O-ß-d-xylopyranosyl-(1''' â†’ 2'')-ß-d-galactopyranoside, kaempferol-3-O-α-l-rhamnopyranosyl-(1''' â†’ 6'')-ß-d-glucopyranoside, kaempferol-3-O-ß-d-glucopyranoside, Kaempferol-3-O-ß-d-xylopyranosyl-7-O-ß-d-glucopyranoside, Kaempferol-3-O-ß-d-xylopyranosyl-(1'''' â†’ 2''')-ß-d-galactopyranoside-7-O-ß-d-glucopyranoside, the oxo-indole derivative spirobrassinin, the phenylthiazole 2-methylsulfanyl-4-phenyl-4,5-dihydro-1,3-thiazole, a series of lysophophatidylethanolamine and 13 different N-phenylpropenoyl-L-amino acids. CONCLUSION: The antibacterial effects of horseradish are only due to the presence of glucosinolates resp. the corresponding ITC, and the detailed overall composition of horseradish extracts has been reported.


Subject(s)
Armoracia , Glucosinolates , Amino Acids , Anti-Bacterial Agents/pharmacology , Armoracia/chemistry , Galactose/analysis , Glucosinolates/analysis , Glucosinolates/chemistry , Glucosinolates/pharmacology , Glycosides/analysis , Indoles , Isothiocyanates/pharmacology , Kaempferols , Molecular Structure , Phytochemicals/analysis , Phytochemicals/pharmacology , Plant Extracts/analysis , Plant Extracts/pharmacology , Plant Roots/chemistry , Thiazoles/analysis
8.
Biosensors (Basel) ; 12(4)2022 Apr 11.
Article in English | MEDLINE | ID: mdl-35448293

ABSTRACT

The toxicity of clothianidin to non-target organisms has gradually attracted world-wide attention. It is essential to develop reliable methods for the on-site detection of clothianidin residue. In this study, analogue-based heterologous ic-ELISAs were designed to rapidly screen desirable hybridomas, which could be used for the construction of recombinant antibodies (RAbs) against clothianidin. Based on the antibody variable region genes, two full-length IgG RAbs (1F7-RAb and 5C3-RAb) were produced by the mammalian cell expression system. The performance of the two RAbs was characterized and compared by heterologous ic-ELISAs and non-competitive surface plasmon resonance (SPR) assays. Using heterologous ic-ELISAs, the 1F7-RAb exhibited highly specific and sensitive recognition to clothianidin with an IC50 of 4.62 µg/L, whereas the 5C3-RAb could bind to both clothianidin and dinotefuran. The results of the non-competitive SPR assay further verified that the 1F7-RAb had a higher specificity and affinity to clothianidin than the 5C3-RAb. Finally, a gold immunochromatographic assay based on the novel antibody, 1F7-RAb, was developed for rapid detection of clothianidin with high sensitivity (visual detection limit of 2.5 µg/L), specificity, and good reproducibility, which can be used as an effective supervision tool for clothianidin residue in agricultural and environmental samples.


Subject(s)
Immunoglobulin G , Thiazoles , Animals , Enzyme-Linked Immunosorbent Assay/methods , Guanidines , Immunoassay/methods , Mammals , Neonicotinoids , Reproducibility of Results , Thiazoles/analysis
9.
Food Chem ; 386: 132752, 2022 Aug 30.
Article in English | MEDLINE | ID: mdl-35339087

ABSTRACT

Zinc-thiazole is a new fungicide that was independently developed in China and has a high efficiency and low toxicity. A modified derivatization method was established to measure zinc-thiazole in foods of plant origin. Zinc-thiazole decomposed into 2-amino-5-mercapto-1,3,4-thiadiazole (AMT) under alkaline conditions, and the AMT was extracted with acidic acetonitrile (pH = 3). The AMT was quantitated by HPLC-MS/MS, and then the amount of zinc-thiazole residue was calculated. Good linearity (R2 > 0.9997) was obtained in 0.001-1 mg/L. The limit of quantification of zinc-thiazole was 0.02 mg/kg in peaches, grapes, brown rice and soybeans. A qualified accuracy (recoveries of 75%-90%) and precision (RSD of 1%-5%) were obtained at three fortified levels. This method was applied to peach samples collected from farmland, and the zinc-thiazole residues complied with the residue limits. In the future, this method could be used to analyze residues and in the risk assessment of metal-thiazole fungicides.


Subject(s)
Fungicides, Industrial , Pesticide Residues , Chromatography, High Pressure Liquid/methods , Fungicides, Industrial/analysis , Pesticide Residues/analysis , Tandem Mass Spectrometry/methods , Thiazoles/analysis , Zinc/analysis
10.
Braz. J. Pharm. Sci. (Online) ; 58: e191026, 2022. tab, graf
Article in English | LILACS | ID: biblio-1384003

ABSTRACT

In this present study, 63 different 5-[4-methyl-2-(pyridin-3/4-yl)thiazole-5-yl]-4-substituted-3-substituted benzylthio-4H-1,2,4-triazole derivatives were synthesized, and evaluated for their in vitro antimicrobial activity against various human pathogenic microorganisms and antioxidant activity. The derivatives were synthesized in a multi-step synthesis procedure including triazole and thiazole ring closure reactions, respectively. The synthesized derivatives (A1-24; B1-39) were screened for their antibacterial, antifungal, and antioxidant activities compared to standard agents. The derivatives possessing 3-pyridyl moiety particularly exhibited relatively high antibacterial activity (MIC= < 3.09-500 µg/mL) against Gram-positive bacteria, and compounds possessing 4-pyridyl moiety showed remarkable antioxidant activity


Subject(s)
Pyridines/analysis , Thiazoles/analysis , Triazoles/analysis , Methods , Antioxidants , In Vitro Techniques/methods , Gram-Positive Bacteria/classification
11.
Braz. J. Pharm. Sci. (Online) ; 58: e19248, 2022. tab, graf
Article in English | LILACS | ID: biblio-1384018

ABSTRACT

The first report about antimicrobial resistance was published in the 1940s. And today, the antimicrobial resistance has become a worldwide problem. Because of this problem, there is a need to develop new drugs. That's why we synthesized some novel thiazolidine-4-one derivatives and evaluated their antimicrobial activity. The final compounds were obtained by reacting 2-[(4,5-diphenylthiazol-2-yl)imino]thiazolidin-4-one with some aryl aldehydes. The synthesized compounds were investigated for their antimicrobial activity against four Candida species, five gram-negative and four gram-positive bacterial species. The lead compounds (4a- h) were obtained with a yield of at least 70%. All compounds showed antimicrobial activity. Compound 4f (MIC: 31.25 µg/ml) exhibited more efficacy than the other compounds against C. glabrata (ATCC 24433). Compound 4b (MIC: 62.5 µg/ml) was the most active compound against all bacterial species, particularly K. pneumoniae (NCTC 9633). Whereas, compound 4c (MIC: <31.25 µg/ml) was observed as the most active compound against E. coli (ATCC 25922). In general, all compounds (4a-4h) showed antimicrobial activity against all fungi and bacterial species. Compounds 4b (2,6-dichlorobenzylidene), 4c (2,6-dihydroxybenzylidene), 4f (1H-pyrrol-2- yl)methylene), 4g (4-triflouromethylbenzylidene) and 4h (2,3,4-trimethoxybenzylidene) were determined as the most active compounds


Subject(s)
Azoles , Thiazoles/analysis , Candida/classification , Thiazolidines/analysis , Reference Drugs , Research Report , Lead/agonists
12.
Sci Rep ; 11(1): 22614, 2021 11 19.
Article in English | MEDLINE | ID: mdl-34799663

ABSTRACT

Mumio (Shilajit) is a traditional medicinal drug known and used for hundreds of years. Bladder cancer is one of the most common cancer types and better treatments are needed. This study analysed the in vitro effect of Mumio on urinary bladder cancer cells (T24 and 5637) in comparison to normal uroepithelial cells (SV-HUC1). Cytotoxicity of Mumio was analysed in these cell lines via MTT and real-time cell growth assays as well via the assessment of the cytoskeleton, apoptosis, and cell cycle. Mumio affected the viability of both cell types in a time and concentration dependent manner. We observed a selectivity of Mumio against cancer cells. Cell cycle and apoptosis analysis showed that Mumio inhibited G0/G1 or S phase cell cycle, which in turn induced apoptosis. Our results showed that Mumio was significantly more cytotoxic to urinary bladder cancer cells than to normal cells. These results are promising and indicate Mumio as a great candidate for urinary bladder cancer treatment and further investigations should be performed.


Subject(s)
Antineoplastic Agents/pharmacology , Drug Screening Assays, Antitumor/methods , Minerals/pharmacology , Resins, Plant/pharmacology , Urinary Bladder Neoplasms/drug therapy , Actins/biosynthesis , Apoptosis , Carcinoma/drug therapy , Cell Cycle/drug effects , Cell Line, Tumor , Cell Proliferation/drug effects , Cell Survival , Cytoskeleton/drug effects , Humans , Tetrazolium Salts/analysis , Thiazoles/analysis
13.
Anal Bioanal Chem ; 413(26): 6617-6626, 2021 Nov.
Article in English | MEDLINE | ID: mdl-34498103

ABSTRACT

Isothiazolinones, a family of biocides, are used as preservatives for their fungicidal, bactericidal, and algacidal properties. These compounds can be found in a wide range of consumer and building products, such as paints, varnishes, shampoos, and liquid detergents. A robust analytical UPLC-MS/MS method to identify and quantify seven isothiazolinones (MIT, CMI, BIT, MBIT, BBIT, OIT, and DCOIT) in consumer products and their emissions was developed and validated according to ISO/IEC 17025. The limits of detection (LODs) ranged from 0.14 µg L-1 (BIT) to 0.54 µg L-1 (CMI). The method was applied for the quantification of the seven isothiazolinones in four types of consumer products (i.e., cosmetics, air fresheners, cleaning products, and building products) and the indoor emissions from a paint. Matrix effects were observed for the shampoo (63-74%), the shower gel (67-84%), and the ceramic glass cleaner (53-57%). All isothiazolinones indicated by the manufacturer (i.e., MIT, CMI, BIT, OIT, and DCOIT) were detected in the products and successfully quantified by the UPLC-MS/MS method.


Subject(s)
Chromatography, High Pressure Liquid/methods , Tandem Mass Spectrometry/methods , Thiazoles/analysis , Cosmetics/analysis , Household Products/analysis , Limit of Detection , Paint/analysis
14.
Regul Toxicol Pharmacol ; 125: 105000, 2021 Oct.
Article in English | MEDLINE | ID: mdl-34233207

ABSTRACT

In 2019, the Dutch Food and Consumer Product Safety Authority performed a market surveillance for toy-slime (23 samples) and putty (16 samples). For 35% of the toy-slimes and 13% of the putties, the migration of boron exceeded the European legal limit of 300 and 1200 mg/kg respectively. In 36% of the toy samples, methylisothiazolinone (MI) and chloromethylisothiazolinone (CMI) were detected in levels up to 25 and 38 mg/kg, respectively, much higher than the European legal limit for aqueous toys intended for children younger than three. 59% of the toys contained other preservatives such as 2-phenoxyethanol, p-hydroxybenzoic acid and parabens. In 2 toy-slimes and 2 putties N-nitrosodiethanolamine (NDELA) was found in amounts up to 2.3 mg/kg. A risk assessment was performed for boron and NDELA. The estimated exposure to boron did not exceed the health based guidance value. The estimated exposure to NDELA from 2 toy-slimes may pose a health risk. For 2 putties the estimated exposure to NDELA was somewhat lower, but health risks could not be excluded. The presence of isothiazolinones may lead to skin sensitisation. It is recommended to extend the legal limit for NDELA, MI and CMI in finger-paint and labelling requirements to other aqueous toys.


Subject(s)
Consumer Product Safety/standards , Hazardous Substances/analysis , Play and Playthings , Boron/analysis , Humans , Netherlands , Thiazoles/analysis
15.
JCI Insight ; 6(10)2021 05 24.
Article in English | MEDLINE | ID: mdl-34027898

ABSTRACT

There is an emerging need for accurate and rapid identification of bacteria in the human body to achieve diverse biomedical objectives. Copper homeostasis is vital for the survival of bacterial species owing to the roles of the metal as a nutrient, respiratory enzyme cofactor, and a toxin. Here, we report the development of a copper-64-labeled bacterial metal chelator, yersiniabactin, to exploit a highly conserved metal acquisition pathway for noninvasive and selective imaging of bacteria. Compared with traditional techniques used to manufacture probes, our strategy simplifies the process considerably by combining the function of metal attachment and cell recognition to the same molecule. We demonstrate, for the first time to our knowledge, how a copper-64 PET probe can be used to identify specific bacterial populations, monitor antibiotic treatment outcomes, and track bacteria in diverse niches in vivo.


Subject(s)
Bacterial Infections , Copper/metabolism , Phenols , Positron-Emission Tomography/methods , Siderophores , Thiazoles , Animals , Bacteria/chemistry , Bacteria/metabolism , Bacterial Infections/diagnostic imaging , Bacterial Infections/microbiology , Disease Models, Animal , Echocardiography , Female , Mice , Mice, Inbred BALB C , Molecular Imaging , Phenols/analysis , Phenols/chemistry , Phenols/metabolism , Siderophores/analysis , Siderophores/chemistry , Siderophores/metabolism , Thiazoles/analysis , Thiazoles/chemistry , Thiazoles/metabolism
16.
Drug Test Anal ; 13(6): 1191-1202, 2021 Jun.
Article in English | MEDLINE | ID: mdl-33547737

ABSTRACT

According to international sport institutions, the use of peroxisome proliferator activated receptor (PPAR)-δ agonists is forbidden at any time in athlete career due to their capabilities to increase physical and endurance performances. The (PPAR)-δ agonist GW501516 is prohibited for sale but is easily available on internet and can be used by cheaters. In the context of doping control, urine is the preferred matrix because of the non-invasive nature of sampling and providing broader exposure detection times to forbidden molecules but often not detected under its native form due to the organism's metabolism. Even if urinary metabolism of G501516 has been extensively studied in human subjects, knowledge on GW501516 metabolism in horses remains limited. To fight against doping practices in horses' races, GW501516 metabolism has to be studied in horse urine to identify and characterize the most relevant target metabolites to ensure an efficient doping control. In this article, in vitro and in vivo experiments have been conducted using horse S9 liver microsome fractions and horse oral administration route, respectively. These investigations determined that the detection of GW501516 must be performed in urine on its metabolites because the parent molecule was extremely metabolized. To maximize analytical method sensitivity, the extraction conditions have been optimized. In accordance with these results, a qualitative analytical method was validated to detect the abuse of GW501516 based on its most relevant metabolites in urine. This work enabled the Laboratoire des Courses Hippiques (LCH) to highlight two cases of illicit administration of this forbidden molecule in post-race samples.


Subject(s)
Doping in Sports/prevention & control , Substance Abuse Detection/methods , Thiazoles/analysis , Administration, Oral , Animals , Female , Horses , Male , Microsomes, Liver/metabolism , PPAR delta/agonists , Thiazoles/metabolism , Thiazoles/urine
17.
Rapid Commun Mass Spectrom ; 35(8): e9050, 2021 Apr 30.
Article in English | MEDLINE | ID: mdl-33470485

ABSTRACT

RATIONALE: GW1516 is a peroxisome proliferator-activated receptor-δ (PPAR-δ) agonist that is banned in horseracing and equestrian sports. Long-term detection and longitudinal distribution of GW1516 in the mane of a horse are reported for the first time and this hair analysis could prolong the detection window of GW1516 for doping control. METHODS: Mane hairs were divided into three segments (0-7, 7-15, and >15 cm from the cut end) and completely pulverized and homogenized for analysis. The pulverized hair samples were extracted with methanol followed by further purification and the extracts were analyzed by liquid chromatography/electrospray ionization high-resolution mass spectrometry (LC/ESI-HRMS) using a Q-Exactive instrument. This method was successfully validated and applied to post-administration samples to confirm the presence of GW1516 and its metabolites and estimate the uptake amounts of GW1516. RESULTS: After administration of 150 mg of GW1516 to a thoroughbred mare, GW1516 was detected in one of two segments of all mane hairs, and four metabolites, namely GW1516 sulfoxide, GW1516 sulfone, 5-(hydroxymethyl)-4-methyl-2-(4-trifluoromethylphenyl)thiazole (HMTT), and 4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylic acid (MTTC), were also identified. The longitudinal distribution analysis results showed that the maximum uptake of GW1516 into hair (approximately 0.05 pg/mg) was observed at around 13 weeks post-administration and GW1516 could be detected and confirmed up to 6 months post-administration. CONCLUSIONS: The parent drug GW1516 was identified as the most appropriate monitoring target in equine hair for controlling its misuse in horses. The use of hair analysis could extend the detection time of GW1516 to at least 6 months after the administration of 150 mg of GW1516 to a thoroughbred mare.


Subject(s)
Chromatography, Liquid/methods , Hair/chemistry , Spectrometry, Mass, Electrospray Ionization/methods , Thiazoles/analysis , Animals , Doping in Sports , Female , Horses , Performance-Enhancing Substances/analysis , Reproducibility of Results , Thiazoles/administration & dosage , Thiazoles/isolation & purification , Thiazoles/metabolism , Time Factors
18.
Anal Bioanal Chem ; 413(7): 1955-1966, 2021 Mar.
Article in English | MEDLINE | ID: mdl-33481048

ABSTRACT

The selective detection of salicylaldehyde skeleton is of great significance in phytochemistry and biological research but rarely reported. In this research, a simple and highly selective "turn-on" fluorescence sensor (CDB-Am) for salicylaldehyde skeleton was developed based on switch of photoinduced electron transfer (PET) and aggregation-induced emission (AIE). CDB-Am bearing amino-cyanodistyrene structure responded to salicylaldehyde in the range of 3.1 to 40 µM with a detection limit of 0.94 µM. The sensing process of formation of Schiff-base adduct CDB-SA was confirmed by 1H NMR, MS, and FT-IR spectra, revealing that a recovered AIE property accounted for the turn-on fluorescence response of CDB-Am and the intramolecular hydrogen bonding played a crucial role in the disruption of PET process. This sensing ability was successfully applied for both fluorescence qualitative test of salicylaldehyde skeleton on TLC analysis and quantitative detection of salicylaldehyde skeleton with good accuracy in the root bark of Periploca sepium, suggesting the extensive applications in phytochemistry and traditional Chinese herbal medicine. Furthermore, CDB-Am exhibited the first excellent fluorescence imaging ability in detecting salicylaldehyde skeleton in a living system. This work supplied a new strategy of preparing a novel "turn-on" fluorescence probe for detecting salicylaldehyde skeleton in complex environments and living bodies.


Subject(s)
Aldehydes/analysis , Fluorescent Dyes/analysis , Schiff Bases/analysis , Spectroscopy, Fourier Transform Infrared/methods , Chromatography, Thin Layer , Fluorescence , Humans , Hydrogen Bonding , Hydroxyl Radical , Imines/chemistry , Limit of Detection , MCF-7 Cells , Magnetic Resonance Spectroscopy , Mass Spectrometry , Medicine, Chinese Traditional , Microscopy, Fluorescence , Optical Imaging , Plant Bark , Plant Roots , Spectrophotometry, Ultraviolet , Tetrazolium Salts/analysis , Thiazoles/analysis
19.
PLoS One ; 16(1): e0245441, 2021.
Article in English | MEDLINE | ID: mdl-33471855

ABSTRACT

Mus musculus and Rattus sp. are considered pest species because they reach high densities in urban areas, crop fields and food storage and productive systems such as breeding farms and orchards. Their control relies mainly on rodenticide application, but the effectiveness of this application is reduced due to behavioural responses and resistance. Novel methods are based on the use of chemical signals as odours that may be attractants, repellents or may reduce the reproductive success of pest species. The aim of this paper is to study the aversive effect of TMT, cat urine and cat body odour on predator-inexperienced Mus musculus and Rattus norvegicus under laboratory conditions. The experimental apparatus comprised three boxes connected by PVC pipes in a linear arrangement. In lateral boxes, odour sources or distilled water were introduced, while animals were placed in the central box at the beginning of the experiment. Rats showed freezing behaviour, reduced visits in the presence of TMT and cat fur. Mice reduced their visits with cat body and cat urine. This study provides evidence of the usefulness of using fear responses as a way to control rodent pests, which must be adapted to the environment and species to be applied.


Subject(s)
Cats , Mice , Predatory Behavior , Rats , Animals , Avoidance Learning , Cats/physiology , Cats/urine , Escape Reaction , Female , Male , Mice/physiology , Odorants/analysis , Rats/physiology , Thiazoles/analysis
20.
Food Chem ; 347: 129044, 2021 Jun 15.
Article in English | MEDLINE | ID: mdl-33472118

ABSTRACT

A colorimetric assay for highly selective and sensitive detection of tricyclazole using fluorescein-functionalized silver nanoparticles (F-AgNPs) as sensing probes was investigated. As the addition of tricyclazole to F-AgNPs, a drastic decrease in the absorbance at 394 nm was detected, which was accompanied with a noticeable color change from yellow to gray. The sensing mechanism involved an interaction between tricyclazole and F-AgNPs, which led to aggregation of the latter, inducing a color change from yellow to gray. An excellent linear calibration curve (R2 = 0.9994) was achieved between absorbance at 394 nm and the tricyclazole concentration in the range between 0.06 and 1.0 ppm. Moreover, the detection limit was estimated at 0.051 ppm. The developed colorimetric assay also showed good selectivity and was successfully utilized to quantify tricyclazole in rice samples with satisfactory recoveries. The proposed assay has been successfully applied for monitoring tricyclazole in rice samples.


Subject(s)
Colorimetry/methods , Metal Nanoparticles/chemistry , Silver/chemistry , Thiazoles/analysis , Fluorescein/chemistry , Limit of Detection , Oryza/chemistry , Oryza/metabolism
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