Search Results (85)

The holistic use of Moringa oleifera Lam. seeds is not as popular amongst rural South Africans. This study screened for the phytochemicals, antimicrobial, and antioxidant potentials as well identifying the compounds in the oils of South African Moringa seed oils using cost-effective thin layer chromatography bioautography and dot blot assays, because fewer studies have been conducted using seed samples from this country. The results obtained indicated that the best oil extract yield (24.04%) was obtained for hexane from 60.10 g of powdered seeds. The yield of the other extracts ranged from 6.2 to 9.5%. Positive test results were obtained for terpenoids, steroids, alkaloids, flavonoids, phenols, and tannins, with potentially good antioxidant properties for scavenging free radicals from 2,2-diphenyl-1-picrylhydrazyl (DPPH) and good antimicrobial activity against Acinetobacter baumannii (BAA 747), Escherichia coli (ATCC 25922), Klebsiella pneumoniae (ATCC 27853), and Pseudomonas aeruginosa (ATCC 27853), with the best zone of inhibition of 314.2 mm² obtained for oil extracted with hexane, followed by dichloromethane, methanol, and acetone oil extracts, respectively. The best minimum inhibitory concentration (MIC) of 0.032 mg/mL against P. aeruginosa was recorded for the hexane oil, compared with ciprofloxacin, which had an MIC of 0.0039 mg/mL against the same pathogen. The identification of the in-oil compounds proposed to mitigate inhibitory activity against the test microbes was carried out through GC-MS analysis matching our results with the GC-MS library. These compounds included ursane-3,16-diol, azetidin-2-one, 1-benzyl-4à-methyl, dibutyl phthalate, 4-methyl-2,4-bis(p-hydroxyphenyl)pent-1-ene, 1H-pyrrole-2,5-dione, 3-ethyl-4-methyl, octopamine rhodoxanthin, 29,30-dinorgammacerane-3,22-diol, 21,21-dimethy, cholan-24-oic acid, 3,7-dioxo, and benzyl alcohol. These are in addition to the stability-indicating marker compounds like oleic acid (54.9%), 9-Octadecenoic acid (z)-, methyl ester (23.3%), n-hexadecanoic acid (9.68%), among others observed over a five year period. Full article

Oligomerization of glyoxal (GL) and methylglyoxal (MG) plays a vital role in secondary organic aerosol (SOA) formation in aqueous aerosols. However, the influence of emerging contaminants on the oligomerization of GL and MG remains unclear. Therefore, using quantum chemical and kinetic calculations, we investigated the oligomerization of GL and MG in the presence of phthalate esters (PAEs), including dimethyl phthalate (DMP), diethyl phthalate (DEP), dipropyl phthalate (DPP), and dibutyl phthalate (DBP), and the role of PAEs in the oligomerization. Our findings indicate that the direct PAE-mediated oligomerization of GL and MG is hindered due to the lack of reactive sites. However, the oligomerization of GL and MG is readily mediated by the hydrolysates of PAEs, which are the preferred forms of PAEs in weakly acidic aerosols, attributable to the additional -OH groups. The mechanisms show that the indirect PAE-mediated oligomerization proceeds via three-step reactions, including nucleophilic attack on carbenium ions, hydration, and deprotonation, which are thermodynamically and kinetically favorable. Our results reveal that the role of PAEs in the GL/MG oligomerization needs to be emphasized, particularly in conditions with a pH value approaching neutrality. Full article

Despite the many current cholesterol-lowering drugs on the market, the persistent surge of hypercholesterolemic-related complications ignites a fascinating search for the discovery of novel therapeutics. This study aimed at investigating the anti-hypercholesterolemic effect of Bauhinia bowkeri extracts. The plant material was sequentially extracted with n-hexane, dichloromethane (DCM), and 70% ethanol. The phytochemical constituents of the extracts were analyzed through GC-MS and the antioxidant activity of the extracts was screened against a wide range of free radicals (ABTS, DPPH, hydroxyl radical, and nitric oxide). The extracts were also screened for the metal iron chelating and reducing power potential. The enzyme inhibitory activity of the extracts on pancreatic lipase, cholesterol esterase, and HMG-CoA reductase as well as the bile acid binding capacity were evaluated. Among the total of 122 compounds detected in the three extracts, only 7 compounds (E-15-Heptadecenal, Diethyl Phthalate, 9,12,15-Octadecatrienoic acid ethyl ester, (Z,Z) Tetradecane 5-methyl, and Octadecane 5-methyl) were found to be common in all the extracts. The extract displayed a varying degree of efficiency on free radicals with IC₅₀ values ranging from 0.07 mg/mL to 0.41 mg/mL. A concentration-dependent inhibition of pancreatic lipase and cholesterol esterase activities, along with a reduction in the bile-binding capacity exhibited by the extracts, was noted. In silico investigations of some of the phytoconstituent revealed significant inhibition of HMG-CoA reductase, cyclooxygenase, and hormone-sensitive lipase with a binding affinity that ranged between −5.1 and −7.0 kcal/mol. These findings suggest that Bauhinia bowkeri extracts possess potential antioxidant and anti-hypercholesterolemic properties. Full article

The aim of this study is to assess the accumulation rates of polycyclic aromatic hydrocarbons (PAHs) and phthalic acid esters (PAEs) in the Nielisz Reservoir. Sediment traps were used at three sites: the upper (N1 station), central (N2 station), and near-dam (N3 station) zones, where they were installed at the bottom in the littoral zone of the reservoir at depths ranging from approximately 1.6 m to 2.5 m. Sampling took place from June to August 2019, and entrapped sediments were analyzed for 16 PAHs and 11 PAEs. Four PAHs, naphthalene (NAP), phenanthrene (PHE), benzo(b)fluoranthene (B(b)F), and benzo(a)pyrene (B(a)P), and two PAEs—di-n-butyl phthalate (DBP) and bis(2-ethylhexyl) phthalate (DEHP)—were identified. Among PAHs, 5-ring compounds dominated, while DBP was the most common PAE. PAH and PAE concentrations in entrapped sediments showed both temporal and spatial variability, but no clear trends were established. The accumulation rate of Σ₄PAH ranged from 47.8 to 458 μg/m²d, with a decreasing trend from the inflow to the dam. The light-to-heavy PAH ratio suggests a pyrogenic origin. Σ₂PAE fluxes were lower, between 1.81 and 17.6 μg/m²d, with no clear spatial variation along the reservoir. Ecotoxicological analysis indicated that PAHs and PAEs could occasionally harm benthic organisms, mainly due to B(b)F. The deposition rates of both PAHs and PAEs are strongly linked to the accumulation of suspended particulate matter (SPM) and organic carbon, particularly of autochthonous origin. Additionally, the pH and salinity of the water significantly influence the accumulation rate of the studied contaminants, especially PAHs. Full article

Phthalic acid esters (PAEs), ubiquitous semi-volatile organic compounds (SVOCs) in indoor environments, pose adverse effects on human health. However, their degradation mechanisms and pathways remain unclear. Herein, we developed an efficient photothermal catalyst by introducing defects (oxygen vacancies, O_Vs) on TiO₂ (P25) surfaces via electron beam irradiation technology with different irradiation doses (100, 300, 500, and 700 kGy). The TiO₂ with defects was employed as a support to prepare Pt-TiO₂ catalysts for the photothermal degradation of di (2-ethylhexyl) phthalate (DEMP) and dimethyl phthalate (DMP), two representative PAEs. TiO₂ pre-treated with a 300 kGy irradiation dose supported the Pt catalyst (Pt-Ti-P-300) and presented the optimal catalytic performance for DEMP and DMP degradation. Characterization results confirmed that O_Vs were successfully introduced to the catalysts. Meanwhile, O_Vs induced by electron beam irradiation expanded the light absorption range and improved the generation and separation of photogenerated carriers, which significantly enhanced the catalytic activity of the catalysts for PAE degradation. Importantly, the degradation mechanism and pathway of DMP were further explored by using in situ diffuse reflectance infrared Fourier transform spectroscopy (DRIFTS) and gas chromatography–mass spectrometry (GC-MS). These findings provide important insights into the electron beam irradiation-mediated regulation of catalysts and the photothermal catalytic removal of PAEs in indoor environments. Full article

Atopic dermatitis (AD) or eczema is an important inflammatory chronic skin disease that brings many complications in its management and treatment. Although several chemical agents are used for treatment, the search for better anti-inflammatory and antibacterial agents of plant origin has been ongoing, since natural compounds, it is commonly believed, are less dangerous than synthetic ones. Therefore, the present study explored a medicinal plant—Eclipta prostrata (L.) L.—for its anti-inflammatory activity alone and in combination with a non-steroidal anti-inflammatory drug (NSAID), diclofenac. The plant extract was used to make a cream formulation for treating atopic dermatitis and as an antibacterial agent against Staphylococcus aures, the major infectious agent associated with AD. The phytochemical analysis of the E. prostrata extract showed the presence of various phytochemicals, including flavonoids, Tannin, saponin, terpenoids, glycosides, phenol, alkaloids, quinone, and protein. The GC-MS profiling of methanolic E. prostrata extract was performed predicted the presence of twenty important phytochemicals, including 2-[5-(2-Hydroxypropyl) oxolan-2-yl]propanoic acid, dl-Menthol, dodecane, undecane, 4,7-dimethyl-, dodecane, 2,6,10-trimethyl-, decane, 2,3,5,8-tetramethyl-, cholest-5-en-3-ol, (3.alpha.)-, TMS derivative, cyclopropane carboxylic acid, 1-hydroxy-, (2,6-di-t-butyl-4-methylphenyl) ester, alpha.-farnesene, propanoic acid, 2-methyl-, 2-ethyl-1-propyl-1,3-propanediyl ester, diethyl phthalate, corticosterone, 2-methylpropionate, hentriacontan-13-ol, O-TMS, phthalic acid, 2,4-dimethylpent-3-yl dodecyl ester, hexasiloxane, 1,1,3,3,5,5,7,7,9,9,11,11-dodecamethyl-, acetic acid, 4-t-butyl-4-hydroxy-1,5-dimethyl-hex-2-ynyl ester, octadecane, 2-methyl- octacosane, 1-iodo-, nonacosane, and eicosyl isopropyl ether. Using an egg albumin denaturation inhibition assay, the anti-inflammatory activities of E. prostrata alone and in combination with diclofenac were investigated, and they showed 93% and 99% denaturation inhibition at 5 mg concentration of E. prostrata in alone and combination with diclofenac, respectively. Heat-induced haemolysis showed 2.5% and 2.4% of haemolysis at 5 mg of E. prostrata alone and in combination with diclofenac, respectively. An MTT assay performed using L₉₂₉ cells proved that the extract has no cytotoxic effect. The plant extract displayed potential antibacterial activity against Staphylococcus aureus; the growth was inhibited at 1 mg/mL of E. prostrata extract. Thus, based on this evidence, the authors suggest that E. prostrata extract should be studied further for its anti-inflammatory and antibacterial activities and topical application in the treatment of atopic dermatitis. Full article

The increasing presence of compostable bioplastics as substitutes for conventional fossil-based plastics necessitates a deeper understanding of their environmental impacts, particularly in marine ecosystems, where they often accumulate. This study examines the leaching potential of different phthalic acid esters (PAEs) from commercial biodegradable plastic bags into natural seawater over a three-month period. Degradation experiments were conducted to investigate the release of PAEs under direct solar radiation exposure and in shielded conditions. ¹H-NMR analysis of the seawater confirmed the release of phthalates, with higher concentrations observed in the samples exposed to sunlight. The leaching rate ranged from 264–342 microgram/g plastic under light exposure to 20–167 microgram/g in dark conditions. These results indicate that the accumulation of compostable plastic waste in coastal marine environments leads to the release of phthalic acid esters, with potential implications for marine ecosystem health and human exposure to these emerging contaminants. Full article

1,2-cyclohexane dicarboxylic acid diisononyl ester (DINCH) is a non-phthalate plasticizer used as a replacement of di(2-ethylhexyl) phthalate (DEHP) in daily usage items. It is not known whether continuous exposure to low doses of DINCH can lead to hepatic alterations, the liver being the organ responsible for its metabolism. The aim of this study was to evaluate the activation of inflammatory and apoptotic pathways in the liver of lactating dams after DINCH exposure, and whether these effects may be observed on postnatal day 6 (PND6) offspring. Two doses of DINCH were tested by oral administration to the following three groups of Long-Evans rats: control, DINCH-lower dose (LDINCH, 30 mg/kg b.w./day), and DINCH-high dose (HDINCH, 300 mg/kg b.w./day). Inflammatory mediators (IL-1β, TNF-α, NF-κB), mitochondrial transcriptional factors (PPARγ and PGC-1α), oxidative stress markers (SOD, CAT, GSSG/GSH), and components of the mitochondrial apoptotic pathway (PUMA, BAX, BAD, Bcl-2, Bcl-xL, Cytochrome c, APAF-1, Caspase-3, AIF) were assessed by the gene and protein expression in the liver of lactating dams and offspring. Exposure to LDINCH promoted the release of pro-inflammatory cytokines such as IL-1β and TNF-α and raised oxidative stress levels (GSSG/GSH), as well as increased Caspase-3 levels and reduced anti-apoptotic proteins (Bcl-2 and Bcl-xL), both in lactating dams and PND6 offspring. Thus, constant exposure to lower doses of DINCH can disrupt inflammatory and oxidant/antioxidant homeostasis, leading to hepatic tissue damage in lactating dams and having a perinatal effect in PND6 offspring. Full article

Catheter-associated urinary tract infections (CAUTIs) cause serious complications among hospitalized patients due to biofilm-forming microorganisms which make treatment ineffective by forming antibiotic-resistant strains. As most CAUTI-causing bacterial pathogens have already developed multidrug resistance, there is an urgent need for alternative antibacterial agents to prevent biofilms on catheter surfaces. As a trial to find out such a potential agent of natural origin, the bark of Tamarix ericoides Rottl., a little-known plant from the Tamaricaceae family, was examined for its antibacterial and antibiofilm activities against one of the major, virulent, CAUTI-causing bacterial pathogens: Enterococcus faecalis. The methanolic T. ericoides bark extract was analyzed for its antibacterial activity using the well diffusion method and microdilution method. Killing kinetics were calculated using time–kill assay, and the ability of biofilm formation and its eradication upon treatment with the T. ericoides bark extract was studied by crystal violet assay. GC-MS analysis was performed to understand the phytochemical presence in the extract. A in vitro bladder model study was performed using extract-coated catheters against E. faecalis, and the effect was visualized using CLSM. The changes in the cell morphology of the bacterium after treatment with the T. ericoides bark extract were observed using SEM. The biocompatibility of the extract towards L₉₂₉ cells was studied by MTT assay. The anti-E. faecalis activity of the extract-coated catheter tube was quantified by viable cell count method, which exposed 20% of growth after five days of contact with E. faecalis. The anti-adhesive property of the T. ericoides bark extract was studied using CLSM. The extract showed potential antibacterial activity, and the lowest inhibitory concentration needed to inhibit the growth of E. faecalis was found to be 2 mg/mL. The GC-MS analysis of the methanolic fractions of the T. ericoides bark extract revealed the presence of major phytochemicals, such as diethyl phthalate, pentadecanoic acid, methyl 6,11-octadecadienoate, cyclopropaneoctanoic acid, 2-[(2-pentylcyclopropyl) methyl]-, methyl ester, erythro-7,8-bromochlorodisparlure, etc., that could be responsible for the antibacterial activity against E. faecalis. The killing kinetics of the extract against E. faecalis was calculated and the extract showed promising antibiofilm activity on polystyrene surfaces. The T. ericoides bark extract effectively reduced the E. faecalis mature biofilms by 75%, 82%, and 83% after treatment with 1X MIC (2 mg/mL), 2X MIC (4 mg/mL), and 3X MIC (6 mg/mL) concentrations, respectively, which was further confirmed by SEM analysis. The anti-adhesive property of the T. ericoides bark extract studied using CLSM revealed a reduction in the biofilm thickness, and the FDA and PI combination revealed the death of 80% of the cells on the extract-coated catheter tube. In addition, SEM analysis showed extensive damage to the E. faecalis cells after the T. ericoides bark extract treatment, and it was not cytotoxic. Hence, after further studies, T. ericoides bark extract with potential antibacterial, antibiofilm, and anti-adhesive activities can be developed as an alternative agent for treating CAUTIs. Full article

Polyvinyl chloride (PVC) belongs to the most widely used group of thermoplastics. Most of the market for PVC products belongs to plasticized compositions. Plasticizers are the most demanded additives in the polymer industry. Environmental problems and the identified toxicity of the plasticizer di(2-ethylhexyl) phthalate (DEHP) stimulate the restriction of its use and contribute to the development of alternative plasticizers. As a possible replacement for phthalates, esters of dicarboxylic acids are known to provide reduced toxicity and high frost resistance to the resulting compositions. In this regard, esters of dicarboxylic acids and ethoxylated alcohols were obtained and their compatibility with polyvinyl chloride was investigated. The plasticizing effect of the esters obtained was evaluated. The thermomechanical characteristics of PVC compositions containing the developed plasticizers were studied, the glass transition temperature was determined, and the areas of the glassy and highly elastic state of the plastics were identified. It was shown that the chemical structure of dicarboxylate used as a plasticizer determines the important technological and operational characteristics of the PVC plastics obtained. Dibutoxyethyl sebacate (DBES) has the best plasticizing effect among the synthesized esters. The expansion of the highly elastic state area for PVC samples containing this ester exceeded the industrial plasticizers DEHP and di(2-ethylhexyl) adipate (DOA). The indicators of the critical temperature of dissolution of PVC in the esters under study suggest ensuring their low migration from PVC plastics. Full article

To predict the behavior of aromatic contaminants (ACs) in complex soil–plant systems, this study developed machine learning (ML) models to estimate the root concentration factor (RCF) of both traditional (e.g., polycyclic aromatic hydrocarbons, polychlorinated biphenyls) and emerging ACs (e.g., phthalate acid esters, aryl organophosphate esters). Four ML algorithms were employed, trained on a unified RCF dataset comprising 878 data points, covering 6 features of soil–plant cultivation systems and 98 molecular descriptors of 55 chemicals, including 29 emerging ACs. The gradient-boosted regression tree (GBRT) model demonstrated strong predictive performance, with a coefficient of determination (R²) of 0.75, a mean absolute error (MAE) of 0.11, and a root mean square error (RMSE) of 0.22, as validated by five-fold cross-validation. Multiple explanatory analyses highlighted the significance of soil organic matter (SOM), plant protein and lipid content, exposure time, and molecular descriptors related to electronegativity distribution pattern (GATS8e) and double-ring structure (fr_bicyclic). An increase in SOM was found to decrease the overall RCF, while other variables showed strong correlations within specific ranges. This GBRT model provides an important tool for assessing the environmental behaviors of ACs in soil–plant systems, thereby supporting further investigations into their ecological and human exposure risks. Full article

Edible ice is often produced by special machines that can represent a source of significant chemical and microbiological contamination. In this work, the presence of phthalic acid esters (phthalates, PAEs) and heavy metals in ice cubes distributed by 77 vending machines installed in two different zones in southern Italy and fed by water from the public water supply was investigated. Solid-phase microextraction coupled to gas chromatography−mass spectrometry (SPME-GC/MS) was used to evaluate contamination with four PAEs, which were selected because they are commonly used in the production of food-contact plastics, while inductively coupled plasma mass spectrometry (ICP/MS) was used to quantify the heavy metals. It was found that ice samples, especially those from one of the two considered zones (zone 2), exceeded the dibutyl phthalate (DBP) threshold limit value; some ice cubes from the other zone (zone 1) instead showed levels of both lead (Pb) and nickel (Ni) up to one order of magnitude higher than those observed in samples collected in zone 2 and higher than the maximum permitted values (European Directive n. 2184/2020). Since the water source connected to the ice vending machines was found to be free from significant levels of all considered target compounds and metals, the high levels of DBP, Ni, and Pb in ice cubes could be attributed to the components and/or to the state of repair of the ice vending machines themselves. Full article

Plastic bottles have gained widespread popularity due to their durability, affordability, and recyclable nature. Phthalic acid esters (PAEs) are used as plasticizers in PET bottle production, which has raised concerns regarding their presence in the environment and potential adverse effects on health, including carcinogenic and endocrine-disrupting properties. PAEs can migrate from PET bottles into the contents, especially when exposed to high temperatures. This study is the first study in Qatar to determine the leaching of DBP, BBP, and DEHP in local PET drinking water bottles under different stressful thermal conditions. GC–MS is a susceptible instrument, and it is an ideal technique to detect and quantify PAEs in collected local plastic water bottles under different storage temperatures, namely at room temperature, 24 °C; 50 °C; and cyclic temperatures of 70 °C. The limits of detection for DBP, BBP, and DEHP were 0.09, 0.33, and 0.93 µg/L, respectively. Five local brands of PET bottles in Qatar were collected and stored under thermal conditions (24, 50, and 70 °C cyclic). Three kinds of leached PAEs, including dibutyl phthalate (DBP), Benzyl butyl phthalate (BBP), and Bis(2-ethylhexyl) phthalate (DEHP), were detected by GC–MS , ranging from 2.84 to 17.32, 1.16 to 21.35, and 0.01 to 19.59 ng/L, respectively. Significant differences were observed between room temperature 24 °C, 50 °C, and cyclic temperature for concentrations of DBP, BBP, and DEHP. Full article

Oestrogen plays a crucial physiological role in both women and men. It regulates reproductive functions and maintains various non-reproductive tissues through its receptors, such as oestrogen receptor 1/oestrogen receptor α (ESR1/Erα), oestrogen receptor 2/oestrogen receptor β (ESR2/Erβ), and G protein-coupled oestrogen receptor 1 (GPER). This hormone is essential for the proper functioning of women’s ovaries and uterus. Oestrogen supports testicular function and spermatogenesis in men and contributes to bone density, cardiovascular health, and metabolic processes in both sexes. Nuclear receptors Er-α and Er-β belong to the group of transcription activators that stimulate cell proliferation. In the environment, compounds similar in structure to the oestrogens compete with endogenous hormones for binding sites to receptors and to disrupt homeostasis. The lack of balance in oestrogen levels can lead to infertility, cancer, immunological disorders, and other conditions. Exogenous endocrine-active compounds, such as bisphenol A (BPA), phthalates, and organic phosphoric acid esters, can disrupt signalling pathways responsible for cell division and apoptosis processes. The metabolism of oestrogen and its structurally similar compounds can produce carcinogenic substances. It can also stimulate the growth of cancer cells by regulating genes crucial for cell proliferation and cell cycle progression, with long-term elevated levels linked to hormone-dependent cancers such as breast cancer. Oestrogens can also affect markers of immunological activation and contribute to the development of autoimmune diseases. Hormone replacement therapy, oral contraception, in vitro fertilisation stimulation, and hormonal stimulation of transgender people can increase the risk of breast cancer. Cortisol, similar in structure to oestrogen, can serve as a biomarker associated with the risk of developing breast cancer. The aim of this review is to analyse the sources of oestrogens and their effects on the endogenous and exogenous process of homeostasis. Full article

Phthalate acid esters (PAEs) are one of the most widely used plasticizers globally, extensively employed in various decoration materials. However, studies on the impact of these materials on indoor environmental PAE pollution and their effects on human health are limited. In this study, forty dust samples were collected from four types of stores specializing in decoration materials (flooring, furniture boards, wall coverings, and household articles). The levels, sources, exposure doses, and potential health risks of PAEs in dust from decoration material stores were assessed. The total concentrations of Σ₉PAE (the sum of nine PAEs) in dust from all decoration-material stores ranged from 46,100 ng/g to 695,000 ng/g, with a median concentration of 146,000 ng/g. DMP, DEP, DBP, and DEHP were identified as the predominant components. Among all stores, furniture board stores exhibited the highest Σ₉PAE (159,000 ng/g, median value), while flooring stores exhibited the lowest (95,300 ng/g). Principal component analysis (PCA) showed that decoration materials are important sources of PAEs in the indoor environment. The estimated daily intakes of PAEs through non-dietary dust ingestion and dermal-absorption pathways among staff in various decoration-material stores were 60.0 and 0.470 ng/kg-bw/day (flooring stores), 113 and 0.780 ng/kg-bw/day (furniture board stores), 102 and 0.510 ng/kg-bw/day (wall covering stores), and 114 and 0.710 ng/kg-bw/day (household article stores). Particularly, staff in wall-covering and furniture-board stores exhibited relatively higher exposure doses of DEHP. Risk assessment indicated that although certain PAEs posed potential health risks, the exposure levels for staff in decoration material stores were within acceptable limits. However, staff in wall covering stores exhibited relatively higher risks, necessitating targeted risk-management strategies. This study provides new insights into understanding the risk associated with PAEs in indoor environments. Full article