Search Results (196)

Background/Objectives: This article reports pyrrolidine iminosugars of L-gulose absolute stereochemical configuration that are functionalised via N-alkylation to bear boronate ester and boronic acid pharmacophores. Inclusion of boron pharmacophores has been shown to reduce toxicity profiles of drugs and can expand the range of interactions between drugs and target enzymes. Methods: The synthetic development, detailed spectroscopic analysis, and biological investigation against glycosidase enzymes and cancer cell lines of these novel five-membered ring iminosugars are reported. Results: This family of iminosugars displays selective, moderate-to-weak inhibition (IC₅₀s = 133–501 μM) of β-d-galactosidase (bovine liver) and emerging inhibition of β-d-glucosidases (almond) and (bovine liver). The boronic acid pharmacophore may be suitable for the management of lysosomal storage disorders to support the restoration of biological activity of mutant enzymes via the chaperone-mediated therapy approach. From a structure–activity perspective, the cancer screening revealed slight growth inhibition in a panel of cancer cell lines, with A2780 ovarian carcinoma cells showing the strongest response across all compounds. Beyond the growth inhibition capabilities, the real therapeutic potential of these borylated drugs lies in their switch-on/switch-off activation under BNCT radiotherapeutic conditions. Conclusions: This is an important novel family of drug leads capable of interacting with drug targets via intermolecular and intramolecular interactions, changing shape and electronics. Introduction of organic boron atoms to organic molecules presents significant synthetic and purification challenges, as well as analysis of the equilibria that arise in aqueous systems. We provide a methodology to achieve all this and introduce boron pharmacophores onto carbohydrate scaffolds in a systematic manner to facilitate a more widespread adoption of boron pharmacophores. Full article

Skeletal muscle, constituting ~40% of body mass, serves as a primary effector for movement and a key metabolic regulator through myokine secretion. Hereditary myopathies, including dystrophinopathies (DMD/BMD), limb–girdle muscular dystrophies (LGMD), and metabolic disorders like Pompe disease, arise from pathogenic mutations in structural, metabolic, or ion channel genes, leading to progressive weakness and multi-organ dysfunction. Gene therapy has emerged as a transformative strategy, leveraging viral and non-viral vectors to deliver therapeutic nucleic acids. Adeno-associated virus (AAV) vectors dominate clinical applications due to their efficient transduction of post-mitotic myofibers and sustained transgene expression. Innovations in AAV engineering, such as capsid modification (chemical conjugation, rational design, directed evolution), self-complementary genomes, and tissue-specific promoters (e.g., MHCK7), enhance muscle tropism while mitigating immunogenicity and off-target effects. Non-viral vectors (liposomes, polymers, exosomes) offer advantages in cargo capacity (delivering full-length dystrophin), biocompatibility, and scalable production but face challenges in transduction efficiency and endosomal escape. Clinically, AAV-based therapies (e.g., Elevidys^® for DMD, Zolgensma^® for SMA) demonstrate functional improvements, though immune responses and hepatotoxicity remain concerns. Future directions focus on AI-driven vector design, hybrid systems (AAV–exosomes), and standardized manufacturing to achieve “single-dose, lifelong cure” paradigms for muscular disorders. Full article

The gel performance of giant squid is weak. Researchers have confirmed that adding some substances could improve the texture. However, the flavor has not been taken into account. In a previous study, we proved that mixed inoculation with Lacticaseibacillus casei and Staphylococcus carnosus with several seasonings adding could improve the texture of squid. Whether the addition of seasonings could affect the quality of samples or not and how fermentation affects the texture and flavor were not clear. In present study, we prepared fermented squid without seasonings. The results showed that compared with fermented samples with added seasonings, samples without seasonings might be safer, with fewer types and lower concentrations of biogenic amines. In samples without seasonings, non-inoculation had a higher pH and higher levels of biogenic amines. Meanwhile, mixed inoculation with L. casei and S. carnosus could ensure safety, improve texture and rheological properties. The water state of the fermented sample was also changed. The microstructure indicated that good network was formed in the fermented sample. After fermentation, the contents of several organic acids, free amino acids and volatile flavor compounds increased, and the results of the electronic nose test were also changed. In addition, starters were dominant during fermentation. These results indicated that mixed inoculation without seasonings might be a safer method than that with seasonings. In addition, mixed inoculation without seasonings could improve the texture and flavor of the squid. These results lay the foundation for improving fermented squid quality in further studies. Full article

Black garlic is a thermally processed product derived from fresh garlic through controlled high-temperature and -humidity conditions. During this process, the formation of 5-hydroxymethylfurfural (5-HMF), a potentially harmful byproduct, is a major quality and safety concern in food processing. This study systematically investigated the distributions of 5-HMF and key process-related biochemical components in black garlic samples from three major production regions in China—Jiangsu, Yunnan, and Shandong. Additionally, correlations between 5-HMF and biochemical components—reducing sugars, amino acids, and organic acids—were analyzed to inform process optimization strategies. Results showed significant regional variation in 5-HMF content, with Jiangsu black garlic exhibiting the highest levels, followed by Yunnan and Shandong (p < 0.05). Partial least squares regression analysis (PLSR) indicated that the key biochemical factors regulating 5-HMF accumulation are primarily organic acids. Among them, citric acid was identified as the most important negative regulator (VIP = 3.11). Although acetic acid (VIP = 1.38) and malic acid (VIP = 1.03) showed positive correlations with 5-HMF, aspartic acid (VIP = 0.41) and fructose (VIP = 0.43) exhibited a weak positive correlation, and arginine (VIP = 0.89) showed weak negative correlations, their effects were far less significant than that of citric acid. Based on these findings, we propose a potential strategy for reducing 5-HMF content in black garlic—selecting raw material cultivars with higher endogenous citric acid levels or exploring the exogenous addition and regulation of citric acid during processing. This study provides a theoretical foundation for understanding the accumulation mechanism of 5-HMF in black garlic and suggests new potential regulatory directions for controlling its content. Full article

Arginine plays a critical role in biomolecular interactions due to its guanidinium side chain, which enables multivalent electrostatic and hydrogen bonding contacts. In this study, atomistic molecular dynamics simulations were conducted across a broad concentration range (26–605 mM) to investigate the thermodynamic and structural features of arginine self-assembly in aqueous solution. Key observables—including hydrogen bond count, radius of gyration, contact number, and isobaric heat capacity—were analyzed to characterize emergent behavior. A three-regime aggregation pattern (dilute, cooperative, and saturated) was identified and quantitatively modeled using the Hill equation, revealing a non-linear transition in clustering behavior. Spatial analyses were supplemented with trajectory-based clustering and radial distribution functions. The heat capacity peak observed near 360 mM was interpreted as a thermodynamic signature of hydration rearrangement. Trajectory analyses utilized both GROMACS tools and the MDAnalysis library. While force field limitations and single-replica sampling are acknowledged, the results offer mechanistic insight into how arginine concentration modulates molecular organization—informing the understanding of biomolecular condensates, protein–nucleic acid complexes, and the design of functional supramolecular systems. The findings are in strong agreement with experimental observations from small-angle X-ray scattering and differential scanning calorimetry. Overall, this work establishes a cohesive framework for understanding amino acid condensation and reveals arginine’s concentration-dependent behavior as a model for weak, reversible molecular association. Full article

Carnitine is essential for the mitochondrial transport of long-chain fatty acids and thus plays a pivotal role in energy metabolism, particularly in metabolically active organs, such as skeletal and cardiac muscle. In patients with dialysis, carnitine homeostasis is disrupted because of the reduced synthesis, impaired renal reabsorption, and carnitine loss during extracorporeal procedures. Carnitine deficiency is linked to a wide range of clinical manifestations, including muscle weakness, treatment-resistant anemia, intradialytic hypotension, mental disorder, and cardiovascular disease. This review provides a comprehensive overview of the physiological function of carnitine, elucidates the underlying mechanisms of carnitine deficiency in patients with dialysis, and explores the clinical consequences. Furthermore, the efficacy and limitations of L-carnitine supplementation in clinical practice are discussed based on the current literature. A better understanding of the pathophysiological and clinical relevance of carnitine deficiency may help facilitate personalized therapeutic strategies for patients with kidney diseases. Full article

This paper presents a systematic analysis of the solid products formed during the cathodic decomposition of chalcopyrite using the acetic acid system. The reduction of chalcopyrite was assessed using different electrochemical and surface characterization techniques. The effect of multiple cathodic polarizations of chalcopyrite immersed in acetic acid was evaluated on the formation of less refractory copper species through the interaction of chalcopyrite with monoatomic hydrogen. The reduction products obtained were characterized by the FESEM/EDS techniques. The results revealed that the iron content in the chalcopyrite lattice was continuously decreased and released into the acetic acid solution when the polarization cycles were increased from 1 to 11 starting from OCP to −2.2 V vs. SHE. The chemical analyses revealed that iron released into the solution corresponds to 0.085 and 1.95 mg/L for 1 and 11 cycles, respectively. The open circuit potential (OCP) measurements of the solid products were shifted to more cathodic potentials than that of chalcopyrite, confirming the possibility to form less refractory species in this weak organic acid. Finally, the FESEM-EDS and XRD analyses showed that chalcopyrite refractoriness decreased, producing Cu, Cu₂S, CuS, CuO, and C₄H₆CuO₄H₂O species depending on the applied energetic condition. Full article

The organic compounds 2-aminopyrimidine (AP) and 4-aminobenzoic acid (PABA) were selected for the synthesis of a compound by establishing the phase diagram and adopting the solid-state synthesis method. The phase diagram analysis suggested the formation of a novel intermolecular compound (IMC) at a 1:1 stoichiometric ratio of AP and PABA, along with two eutectics at 0.25 and 0.90 mole fractions of AP. FTIR and NMR spectroscopy were used for the structure elucidation of the intermolecular compound. The powder X-ray diffraction analysis revealed the novel nature of IMC (APPABA) and the mechanical mixture nature of eutectics. The sharp and single peak of the DSC curve suggested the melting and pure nature of the synthesized IMC. Various thermodynamic parameters of IMC and eutectics were studied. A single crystal of the IMC was grown from solution and its single-crystal X-ray diffraction analysis revealed that it crystallized in a monoclinic system with the P21/n space group. Hirshfeld surface analysis further validated the weak non-covalent interactions summarized through the single-crystal X-ray analysis. Studies on the IMC were thoroughly conducted to evaluate its antibacterial activity with reference to antibiotics, and it showed significant positive responses against various pathogenic microbial isolates (Staphylococcus aureus, Escherichia coli, Pseudomonas aeruginosa, Klebsiella aerogenes, and Shigella boydii) and non-pathogenic microbial isolates (Enterobacter cloacae, Pseudomonas azotoformans, and Burkholderia paludis). It was also found effective against methicillin-resistant bacterial strains viz. Staphylococcus aureus MRSA. Full article

The Minghuazhen Formation in the Cangdong Sag of the Bohai Bay Basin is a key sedimentary unit for investigating regional provenance evolution, paleoclimate variations, and hydrocarbon potential in Eastern China. This study integrates mineralogical and geochemical analyses to explore sedimentary characteristics. Techniques include X-ray diffraction (XRD), major/trace element compositions, rare earth element (REE) distributions, and organic carbon content. XRD data and elemental ratios (e.g., Al/Ti, Zr/Sc) suggest a predominant felsic provenance, sourced from acidic magmatic rocks. The enrichment with light rare earth elements (LREE: La–Eu) and notable negative Eu anomalies in the REE patterns support the interpretation of a provenance from the Taihangshan and Yanshan Orogenic Belts. Geochemical proxies, such as the Chemical Index of Alteration (CIA) and trace element ratios (e.g., U/Th, V/Cr, Ni/Co), indicate a warm and humid depositional environment, characterized by predominantly oxic freshwater conditions. Organic geochemical parameters, including total organic carbon (TOC), total nitrogen (TN), and C/N ratios, suggest that organic matter primarily originates from aquatic algae and plankton, with C/N values predominantly below 10 and a strong correlation between TOC and TN. The weak correlation between TOC and total carbon (TC) indicates that the organic carbon is mainly biological in origin rather than carbonate-derived. Although the warm and humid climate promoted the production of organic matter, the prevailing oxic conditions hindered its preservation, resulting in a relatively low hydrocarbon generation potential within the Minghuazhen Formation of the Cangdong Sag. These findings provide new insights into the sedimentary evolution and hydrocarbon potential of the Bohai Bay Basin. Full article

Background and Clinical Significance: Cerebrotendinous xanthomatosis (CTX) is a rare autosomal recessive disorder caused by mutations in the CYP27A1 gene, leading to impaired bile acid synthesis and systemic cholesterol deposition. The condition presents with a broad spectrum of symptoms affecting multiple organs and systems, including the eyes, central nervous system, tendons, and skeletal muscles. Due to its heterogeneous and often ambiguous clinical manifestations, CTX is frequently misdiagnosed or remains undiagnosed for years. Case Presentation: We report the case of a 37-year-old male who was admitted to our university hospital with a long-standing history of progressive muscle weakness in the arms and legs. His medical history revealed bilateral cataract surgery in childhood, cognitive decline, epilepsy, and bilateral round swellings of the Achilles tendons, suspected to be xanthomas. A clinical diagnosis of CTX was established, and sequencing analysis confirmed the presence of a homozygous pathogenic variant in the CYP27A1 gene. Despite the unavailability of chenodeoxycholic acid (CDCA) therapy in Bulgaria, symptomatic management was provided. Conclusions: This case underscores the diagnostic challenges associated with CTX and highlights the prolonged diagnostic journey faced by patients with rare neurogenetic disorders. It also emphasizes the need for increased awareness and early recognition of such conditions to improve patient outcomes. Full article

A variety of variables, such as organic matter input, redox conditions, depositional rates, and terrigenous input, affect the deposition of black shale. Furthermore, because of the significant regional variations in paleodepositional environments, these factors have a complex role in organic matter enrichment. Global geological events influenced sedimentary conditions, organic enrichment, and the development of organic-enriched shales during the Late Ordovician to Early Silurian. The Wufeng–Longmaxi Formation black shales in Southeastern Chongqing were analyzed for X-ray diffraction (XRD), major and trace element geochemistry, and total organic carbon (TOC) data; this led to further analysis of the relationship between the depositional environment and organic matter aggregation and rock type evolution. The primary minerals found in the Wufeng–Longmaxi shale are quartz, feldspar, carbonatite (calcite and dolomite), and clay. The high index of compositional variability (ICV) values (>1) and the comparatively low chemical index of alteration (CIA) values (52.6–72.8) suggest that the sediment source rocks are juvenile and are probably experiencing weak to moderate chemical weathering. The selected samples all show negative Eu anomalies, flat heavy rare earth elements, and mildly enriched light rare earth elements. The ratios of La/Th, La/Sc, Th/Sc, ΣREE-La/Yb, TiO₂-Ni, and La/Th-Hf suggest that acidic igneous rocks were the main source of sediment, with minor inputs from ancient sedimentary rocks. The correlations of paleoclimate proxies (Sr/Cu, CIA), redox proxies (V/Cr, V/Ni, V/(V + Ni), Ni/Co, U/Th), paleoproductivity proxies (Ba_xs, Cu_EF, Ni_EF), and water mass restriction proxies (Mo/TOC, U_EF, Mo_EF) suggest a humid–semiarid, anoxic, moderate–high paleoproductivity, and moderate–strongly restricted environment. On the basis of the aforementioned interpretations, the paleoenvironment of the Wufeng–Longmaxi Formations was established, with paleoredox conditions and restricted water masses likely being the primary factors contributing to organic matter enrichment. Full article

This study aimed to investigate the content of major bioactive compounds and characterize the volatile and sensory profiles of Coffea canephora flowers and their infusions. Dried flowers from six selected genotypes of C. canephora trees and their infusions were analyzed for bioactive compounds using HPLC–DAD, while volatile organic compounds (VOC) were analyzed using GC–MS. Eight chlorogenic acids (CGA), seven phenolic acids, and the alkaloids caffeine and trigonelline were quantified in all methanolic flower extracts. Total CGA, phenolic acids, caffeine, and trigonelline contents in the methanolic extracts ranged between 342.8 and 1079.4 mg/100 g, 27.1 and 41.0 mg/100 g, 515.6 and 745.9 mg/100 g, and 453.8 and 645.2 mg/100 g, respectively. CGA, caffeine, and trigonelline were well extracted (84%, 91%, and 74%, respectively) when the flowers were infused in hot water. No free phenolic acids were identified in the infusions. Eighty-five VOC were identified in the flowers. Aldehydes, monoterpenes, esters, alcohols, monoterpene alcohols, acids, and ketones prevailed in order of the number of compounds. In the infusions, 38 VOC were accurately identified. Monoterpenes and monoterpene alcohols prevailed. In general, floral, jasmine and orange blossom, herbal, green coffee, woody, and sweet were the most cited sensory attributes for fragrance, aroma, and flavor. Considering the typically weak aroma of C. canephora seeds, the aroma and flavor of the flower’s infusions were surprisingly strong and pleasant, showing great marketing potential. Full article

Three new inorganic-organic hybrid compounds, (H₃DIBA)₂·SiMo₁₂O₄₀·H₂O (1), (H₃DIBA)₂·SiW₁₂O₄₀·H₂O (2), and [(H₂DIBA)(H₃DIBA)]·PMo₁₂O₄₀·2H₂O (3) (HDIBA = 3,5-di(1H-imidazol-1-yl)benzoic acid) were synthesized by the hydrothermal method. The structures were characterized by single-crystal X-ray diffraction, elemental analysis, powder X-ray diffraction, infrared spectroscopy, and thermogravimetric analysis. These three compounds are all 3D supramolecular structures formed by Keggin-type polyoxometalate anions and HDIBA through intermolecular weak interactions, which have been studied via Hirshfeld surface analysis. The electrochemistry properties of 1 and 3 have been studied, including cyclic voltammetric behaviors and electrocatalytic properties. The study on the removal of organic dye pollutants in water showed that compounds 1 and 3 had an adsorption effect on cationic dye RhB, and the adsorption process conforms to the Langmuir isotherm model. Compound 2 can photocatalytically degrade cationic organic dyes RhB, MB, and CV, and the photocatalytic mechanism study indicates that h⁺ plays a major role in the photocatalytic process. Full article

The development of an energy-saving method to recycle expensive carbon fibers (CFs) from end-of-life thermosetting resin-based CF-reinforced composites (CFRCs) is strongly desired because of the environmental and economic issues. The replacement of traditional thermosetting matrixes with controllably degradable epoxy resins provides a promising solution to this challenging task. In this work, a liquid acetal-containing semi-cycloaliphatic epoxy resin (H-ER) is designed and synthesized. After curing, H-ER shows simultaneously increased thermal stability, shearing strength, flexural strength, strain at break, and critical stress intensity factors by 126%, 26.5%, 17.0%, and 29.5%, respectively, in comparison with ERL-4221. Particularly, the cured H-ER is sufficiently resistant to organic solvents, bases, and weak acids but degrades rapidly in a modestly strong acidic aqueous solution, and the rate of degradation is controlled by modulating the acidity. GC-MS and FTIR spectra demonstrate that the degradation is indeed due to the cleavage of acetal linkages in the network, and the degradation-generated benzaldehyde may be reused as a raw material for the synthesis of the H-ER resin. More importantly, for the CFRCs using H-ER as a matrix, the CFs are readily recovered without detectable damage and are able to be recycled for CFRC fabrication. Full article

Anaerobically digested digestate is mostly used as organic fertilizer, but there is still a potential risk of heavy metal pollution. Biochar and bio-organic fertilizer through passivation can effectively reduce the mobility of heavy metal ions in soil, with the strong adsorption capacity of heavy metals, and are widely used in soil remediation. In this study, digestate as raw material supplemented with biochar was applied to simulated heavy metal-contaminated soil, and its effects on heavy metal content and the transformation of forms in soil and crop systems were systematically investigated. The application of biochar-based organic fertilizer to simulated heavy metal-contaminated soils resulted in large differences in the morphological distribution of heavy metals, which was reflected in a significant decrease in the content of heavy metals in the weakly acid-extractable state and an increase in the content of heavy metals in the residue state, and promoted the transformation of soil heavy metals from the weakly acid-extractable state to the residue state. There were differences in the accumulation of heavy metals in the above ground and below ground parts of cabbage, and Cu, Zn, Cd, and Pb were mainly accumulated in the below ground parts of the plants. The present study offers an effective methodology for the remediation of soil and plant contamination by a range of heavy metals (Cu, Zn, Cd, and Pb), from the weak acid extraction stage to the residue stage. This approach is of particular significance for the advancement of sustainable agriculture and environmental remediation. Full article