Enhanced removal of nano-oil droplets utilizing polysilicate aluminum ferric (PSAF): Leveraging bridging and non-polar surface advantages.

Hydraulic oil leaks during mechanical maintenance, resulting in flushing wastewater contaminated with dispersed nano-oil droplets. In this study, 75 mg L-1 of polysilicate aluminum ferric (PSAF) was stirred at 350 rpm and the optimal chemical oxygen demand (COD) removal was 71%. The increase of PSAF led to more hydrolysis of Fe, and 1,175 cm-1 hydroxyl bridged with negative oil droplets. At the same molar concentration, PSAF hydrolyzes cationic metals more rapidly than polymeric aluminum chloride (PAC). PSAF forms flocs of smaller complex structures with greater bridging. The Al-O and Si-O peaks occurred at 611 and 1,138 cm-1, indicating the formation of Si-O-Fe and Si-O-Al bonds on the flocs surface. Higher stirring speeds did not change the free energy of the flocs surface γTot, mainly because the decrease in the van der Waals force (γLW) offset the increase of Lewis acid-base force (γAB). Preserving the non-polar surface, in summary, owing to its bridging abilities and affinity for non-polar surfaces, PSAF demonstrates superior efficiency over PAC in capturing and removing oil droplets.

Structure elucidation of a new terpenylated coumarin with the combination of CASE algorithms and DFT/NMR approach.

One new terpenylated coumarin ailanthuscoumarin was isolated from the root barks of Ailanthus altissima (Mill.) Swingle. The high oxidation of the compound led to the difficulty of structure elucidation by 2D-NMR spectra. Its structure was determined with the aid of computer-assisted structure elucidation (CASE) expert systems and Gauge-independent atomic orbital (GIAO) NMR calculations. The absolute configuration of ailanthuscoumarin was determined by the comparison between the experimental and calculated electronic circular dichroism (ECD) spectra. The anti-hepatoma activity of ailanthuscoumarin against two human hepatoma cells (Hep3B, HepG2) was also reported.

Benzoic acid derivatives from the root barks of Ailanthus altissima.

Two new benzoic acid derivatives (1-2), together with four known compounds (3-6) have been isolated from the n-BuOH soluble fraction of ethanolic extract from Ailanthus altissima. The gross structures of the new compounds were deduced by detailed spectroscopic analysis including HRESIMS and 1D/2D NMR spectroscopy. The stereochemistry of 1 was determined by modified Mosher's method. All compounds were evaluated for their neuroprotective effects against H2O2-induced oxidative stress in human neuroblastoma SH-SY5Y cells and none of them displayed obvious neuroprotective activities. [Formula: see text].

Investigation of chemical constituents of safflower and their tyrosinase inhibitory activity.

Investigation on bioactive chemical constituents of safflower led to the isolation of 10 compounds from the aqueous extract, including a new alkaloid (1), a new glucopyranoside (2), and 8 known compounds (3-10). The structures of two new compounds were elucidated on the basis of extensive spectral analyses, including 1D, 2D-NMR and HRESIMS. Biological research on the isolates indicated that compounds 3, 4 and 9 remarkably inhibited tyrosinase with IC50 at 0.11, 0.20 and 0.11 mM, respectively, compared with the positive control arbutin (0.26 mM). To investigate the interaction between enzyme and isolated compounds, an in silico docking study was carried out. The research provided valuable experience for phytochemistry and biological investigation on safflower.

Flavonoids and their derivatives with ß-amyloid aggregation inhibitory activity from the leaves and twigs of Pithecellobium clypearia Benth.

To explore potential compounds with marked effect on Alzheimer's disease (AD) in Pithecellobium clypearia Benth., nineteen compounds (1-19) were obtained, including two new flavonoid derivatives, named pithecellobiumol A (1) and pithecellobiumol B (2) and 17 flavonoids (3-19). Their structures were elucidated based on 1D and 2D-NMR spectra as well as HR-ESI-MS data. The absolute configurations of new compounds were assigned by comparing their experimental specific rotation or ECD curves with the calculated data. The inhibitory activity on Aß aggregation was screened by ThT assay, and compounds 7 (70.7%), 9 (86.5%), 10 (88.4%), 15 (86.1%) and 16 (87.7%) showed outstanding inhibition rate at 20µM compared to the positive control, curcumin (65.64%). In addition, docking study was performed to initially examine possible molecular mechanisms. Considering the important role of oxidative stress in AD, all the isolated compounds were tested for their H2O2-induced damage in human neuronblastoma SH-SY5Y cells. Among them, compound 16 (91.0%) was the most potent candidate in the treatment of AD.

The influence of different levels of physical activity and sports performance on the accuracy of dynamic lower limbs balance assessment among Chinese physical education college students.

Background: Balance ability is the basis of human actions. Improving the accuracy of dynamic balance assessment can increase the efficiency of sports injury prediction. Objectives: This study aimed to investigate how physical activity and sports performance affect the dynamic balance ability of lower limbs and validate whether the Lower Quarter Y-Balance Test (YBT-LQ) is a reliable predictor of sports injury risk among Chinese physical education college students. Materials and Methods: In total, 169 voluntary participants completed the YBT-LQ at the beginning of a semester and provided some physiological information and an injury report at the end of the semester. The correlation between YBT-LQ performance and selected factors that can affect the dynamic balance control was analyzed based on data statistics. The receiver operating characteristic (ROC) and the area under curve (AUC) of the composite scores of the YBT-LQ were calculated to explore an optimal cutoff value for predicting sports injury risk. Results: The composite scores of the YBT-LQ exhibited strong correlations with both the sports performance level and sports injury, as well as a moderate correlation with physical activity level, age (negative), and metabolic equivalent (MET). In the entire study population, the area under the receiver operating characteristic (ROC) curves for the binary classification of composite YBT-LQ scores of the left and right legs to predict sports injury risk were 0.78 and 0.74, respectively. Stratifying the study participants based on their levels of physical activity and sports performance had an effect on the AUC values of ROC curves. The optimal cutoff scores of the YBT-LQ for predicting sports injury risk were variable, with values more or less than 95%. Specifically, the cutoff scores for participants with the highest level of sports performance were notably higher, reaching up to 106.5% (left) and 107.2% (right). Conclusion: Physical activity and sports performance can influence human dynamic balance control. Composite scores of the YBT-LQ can be used with acceptable efficiency to predict sports injury. Stratifying participants based on their levels of physical activity and sports performance leads to different optimal cutoff values of the YBT-LQ composite scores in predicting sports injury. This approach is preferable to relying solely on a uniform 95% cutoff. It is recommended to analyze individuals with higher levels of sports performance, such as elite athletes, separately from those with lower levels. This is because the former group has a higher optimal cutoff value compared to the latter.

Tunable high-sensitivity sensing detector based on Bulk Dirac semimetal.

This paper proposes a tunable sensing detector based on Bulk Dirac semimetals (BDS). The bottom-middle-top structure of the detector is a metal-dielectric-Dirac semimetal. The designed detector is simulated in the frequency domain by the finite element method (FEM). And the simulation results indicate that the detector achieves three perfect absorption peaks with absorptivity greater than 99.8% in the range of 2.4-5.2 THz. We analyze the cause of the absorption peak by using random phase approximation theory. The device exhibits good angular insensitivity in different incident angle ranges, and the three absorption peaks can reach 90% absorption rate when the incident angle is in the ranges of 0-60°. And when adjusting the Fermi level of BDS in the ranges of 0.1-0.5 eV, our detector can realize the frequency regulation of the ultra-wide range of 3.90-4.56 THz and realize multi-frequency controllable sensing while maintain the absorption efficiency above 96%. The detector has maximum sensitivity S of 238.0 GHz per RIU when the external environment of the refractive index changes from 1.0 to 1.8, and the maximum detection accuracy is 6.5. The device has broad development prospects in the field of space detection and high-sensitivity biosensing detection.

Self-Catalyzed Phototandem Perfluoroalkylation/Cyclization of Unactivated Alkenes: Synthesis of Perfluoroalkyl-Substituted Quinazolinones.

A novel visible-light-induced radical tandem trifluoromethylation/cyclization of unactivated alkenes with sodium perfluoroalkanesulfinates (Rf = CF3, C3F7, C4F9, C6F13, C8F17) under air atmosphere has been developed. A range of quinazolinones containing unactivated alkene moiety and sodium perfluoroalkanesulfinates were compatible with this transformation, leading to a variety of perfluoroalkyl-substituted quinazoline alkaloids. Remarkably, the experiment can be carried out without any metal catalyst, strong oxidant, or external photosensitizer.

PET/Ag NW/PMMA transparent electromagnetic interference shielding films with high stability and flexibility.

Flexible transparent electromagnetic interference (EMI) shielding materials in visual windows are essential for the innovation of optoelectronic devices. Herein, we demonstrate the fabrication of flexible EMI shielding films based on silver nanowires (Ag NWs) and polymethyl methacrylate (PMMA). The purified Ag NWs are uniform in size and morphology, with aspect ratio over 1000. The PET/Ag NW/PMMA flexible transparent conductive films (FTCFs) with a sandwich structure were obtained via Mayer-rod coating of the Ag NWs and spin-coating of the PMMA polymer on a polyethylene terephthalate (PET) substrate. The root mean square roughness value of PET/Ag NW/PMMA FTCFs could decrease from 21 nm to 4 nm due to the filling of PMMA in the interface among Ag NWs. The PET/Ag NW/PMMA FTCFs can achieve a sheet resistance of 21 Ω sq-1 at a transmittance of 95.6%, resulting in a high figure of merit of 447. Moreover, the composite films exhibit remarkable flexibility after 10 000 continuous bending cycles, as well as great stability in harsh environments of 80 °C/80% RH aging for 600 h. An EMI shielding effectiveness (SE) of 21.3 dB in combination with a high optical transmittance of 95.6% for the PET/Ag NW/PMMA FTCFs is sufficient to satisfy the requirement of commercial transparent EMI shielding applications. The absorption component of the SE was demonstrated to play a dominant role in the EMI shielding mechanism. The comprehensive performance (flexibility, stability, transparency and EMI shielding performance) makes the PET/Ag NW/PMMA FTCFs have great potential as a flexible transparent EMI shielding material in emerging flexible optoelectronic devices.

Visible Light/Tertiary Amine Promoted Synergistic Hydroxydifluoroacetamidation of Unactivated Alkenes under Air.

An efficient and novel method for regioselective hydroxydifluoroacetamidation of alkenes with bromodifluoroacetamides has been achieved via a tandem radical pathway mediated by photoredox catalysis under metal-free conditions. This transformation proceeded smoothly in the presence of Rhodamine 6G, affording a series of α,α-difluoro-γ-hydroxyacetamides in moderate to excellent yields. The significant advantages of this protocol are the low-cost photocatalyst, readily available starting materials, synthetic convenience, and wide functional group compatibility.

Triterpenes from Archidendron clypearia (Jack) I.C.N. with anti-ß-amyloid aggregation activity.

A new triterpene as well as five known compounds were isolated from the twigs and leaves of Archidendron clypearia (Jack) I.C.N. Their structures were established by comprehensive spectroscopic analyses including 1D, 2D NMR and HRESIMS data. The ability of all isolated compounds to inhibit ß-amyloid aggregation was investigated by a ThT-based fluorometric assay. Among them, compounds 3 (67.8%) and 6 (77.7%) exhibited higher inhibitory activity than the positive (48.0%). In addition, molecular dynamics and molecular docking have been utilized to predict the detailed binding interaction between ligands and Aß1-42.

The identification of phenylpropanoids isolated from the root bark of Ailanthus altissima (Mill.) Swingle.

Chemical investigation of 75% EtOH exact of the root bark of Ailanthus altissima (Mill.) Swingle led to the isolation and identification of two new phenylpropanoids (1-2), along with six known compounds (3-8). Their chemical structures were elucidated by extensive spectroscopic data analyses including NMR experiments and HRESIMS analyses, as well as computer-assisted structure elucidation software (ACD/Spectrus Processor). All compounds were evaluated for cytotoxic activities against Hep 3B and Hep G2 cells. Compound 1 and 7 displayed weak cytotoxic activities against the Hep 3B cell line.

Highly efficient and stable transparent electromagnetic interference shielding films based on silver nanowires.

Transparent electromagnetic interference (EMI) shielding materials with high optical transmittance and outstanding shielding effectiveness (SE) for optoelectronic devices in visual windows are urgently needed. Herein, we demonstrate the preparation of a transparent EMI shielding film based on silver nanowires (Ag NWs) via a facile Mayer-rod coating method. The electrical conductivity and transmittance of Ag NW-based films can be greatly improved through treatment with NaBH4 and the lamination of poly(diallyldimethyl-ammonium chloride). The coverage of the polymer decreases the surface roughness, with no damage on the uniform mesh of the Ag NWs. The Ag NW/PDDA composite films present a sheet resistance of 22 Ω sq-1 at a transmittance of 95.5%, better than that of commercial indium tin oxide (ITO). The excellent optoelectrical performance of the Ag NW/PDDA composite film is further ascertained by fitting the transmittance with the resistance, with a figure of merit of 443. The Ag NW/PDDA composite films in this study exhibit greatly improved stability during 25 °C/65% RH aging for 35 days with the assistance of the coverage layer. Moreover, the EMI SE of the Ag NW/PDDA composite films is 28 dB on average at a transmittance of 91.3%, and continuously increases to 31.3 dB while the optical transmittance is still maintained at 86.8%, which is superior to those of most reported transparent EMI shielding materials. Taken together, the excellent optical transmittance and EMI shielding performance of the Ag NW/PDDA composite film make it an outstanding transparent EMI shielding material in optoelectronic devices, such as aerospace equipment, medical devices, communication facilities, and electronic displays.

Chiral resolution and bioactivity of enantiomeric furofuran lignans from Juglans mandshurica Maxim.

Enantiomers have generally been reported mostly for racemic mixtures with a 1:1 ratio, as in that case there were weak Cotton effects in the ECD spectrum and negligible optical rotations. A furofuran lignan (sesamin), with a remarkable rotation and significant Cotton effects, was isolated from Juglans mandshurica Maxim. Subsequently, sesamin was resolved by chiral HPLC to afford a pair of enantiomers, (+)-sesamin (a) and (-)-sesamin (b), in a ratio of approximately 1:3. Their absolute configurations were determined by computational analysis of their electronic circular dichroism (ECD) spectrum. In addition, the pair of enantiomers were evaluated for the inhibition of self-induced Aß aggregation. Interestingly, (+)-sesamin (a) (67.7%) and (-)-sesamin (b) (80.6%) exhibited different degrees of anti-Aß aggregation activity. The different inhibition profiles were further explained by molecular dynamics and docking simulation study.

Anti-ß-amyloid aggregation activity of enantiomeric furolactone-type lignans from Archidendron clypearia (Jack) I.C.N.

The phytochemical investigation on the twigs and leaves of Archidendron clypearia (Jack) I.C.N. led to the isolation of three pairs of furolactone-type lignans enantiomers, including a pair of new compounds (1R,5S,6S)-Kachiranol (1a) and (1S,5R,6R)-Kachiranol (1b) and four known compounds (2a/2b and 3a/3b). Separation of the furolactone-type lignans enantiomeric mixtures was achieved using chiral HPLC for the first time. Their structures were determined by spectroscopic analysis and comparison between the experimental and calculated electronic circular dichroism (ECD) spectra. All optical pure compounds were evaluated for their inhibitory effects on ß-amyloid aggregation by ThT assay. Among them, the inhibitory activity of the compound 1b (71.1%) was higher than the positive control (61.0%) and other compounds. In addition, molecular dynamics and molecular docking were employed to explore the binding relationship between the ligand and the receptor.

Terpenylated coumarins from the root bark of Ailanthus altissima (Mill.) Swingle.

Seven undescribed terpenylated coumarins, named altissimacoumarin I-O, together with seven known compounds, altissimacoumarin C, altissimacoumarin E, altissimacoumarin G, altissimacoumarin H, puberulin, 7-(3-Methyl-2-butenyloxy)-6-methoxycoumarin and artelin were isolated from the root bark of Ailanthus altissima (Mill.) Swingle. Their structures were elucidated by comprehensive spectra data analysis, NMR calculation, DP4+ analysis and ACD/Structure Elucidator software simulation. The absolute configurations of altissimacoumarins K, L, M and N were determined by modified Mosher's method. All isolates were tested for their cytotoxic effect against two hepatoma carcinoma cell lines (HepG2, Hep3B). Altissimacoumarin C exhibited moderate cytotoxic effect against Hep3B cells, with IC50 of 45.21 µM.

Visible-Light-Induced Regioselective Alkylation of Coumarins via Decarboxylative Coupling with N-Hydroxyphthalimide Esters.

An efficient photocatalytic decarboxylative 3-position alkylation of coumarins by using alkyl N-hydroxyphthalimide esters as alkylation reagents has been developed. A variety of NHP esters derived from aliphatic carboxylic acids (primary, secondary, and tertiary) has been proved to be tolerated for this decarboxylation process, affording a broad scope of 3-alkylated coumarin derivatives in moderate to excellent yields. This protocol was highlighted by its mild conditions, readily available starting materials, operational simplicity, and wide functional group tolerance.

Construction of C(sp2 )-C(sp3 ) Bond between Quinoxalin-2(1H)-ones and N-Hydroxyphthalimide Esters via Photocatalytic Decarboxylative Coupling.

A novel visible-light-driven decarboxylative coupling of alkyl N-hydroxyphthalimide esters (NHP esters) with quinoxalin-2(1H)-ones has been developed. This C(sp2 )-C(sp3 ) bond-forming transformation exhibits excellent substrate generality with respect to both the coupling partners. Of note, a series of 3-primary alkyl-substituted quinoxalin-2(1H)-ones that were difficult to synthesize by previous methods could be obtained in moderate to excellent yields. Additionally, the mild conditions, easy availability of substrates, wide functional group tolerance and operational simplicity make this protocol practical in the synthesis of 3-alkylated quinoxalin-2(1H)-ones.

Network pharmacology-based screening of the active ingredients and potential targets of the genus of Pithecellobium marthae (Britton & Killip) Niezgoda & Nevl for application to Alzheimer's disease.

Alzheimer's disease (AD) is a progressive neurodegenerative disorder associated with synaptic dysfunction, pathological accumulation of ß-amyloid (Aß), and neuronal loss. Given the prevalence of AD and the lack of effective long-term therapies, there is a pressing need to discover viable leads that can be developed into clinically approved drugs with disease-modifying effects. The analysis of current reported literatures confirms the importance of the plants of Pithecellobium genus as candidate against AD. Hence, it is necessary to identify selective anti-dementia agents from this genus. To explore potential compounds with marked effect on AD in Pithecellobium genus, a compound database based on the methods of network pharmacology prediction was established in this paper by constructing the compound-disease target network. The result showed that the most effective compound in the plants of this genus might be (7'R,8'R)-7'-methoxyl strebluslignanol, and the most potential target might be Macrophage colony-stimulating factor 1 receptor.

Enantiomeric 8,4'-type oxyneolignans from the root barks of Ailanthus altissima (Mill.) Swingle and their neuroprotective effects against H2O2-induced SH-SY5Y cells injury.

Ailanthus altissima Swingle is a deciduous tree, belonging to the Simaroubaceae family. Phytochemical investigation of the root barks of A. altissima showed the presence of eight pairs of enantiomeric 8,4'-type oxyneolignans (1a/1b-8a/8b) including nine undescribed compounds (1b, 2a, 3a/3b, 4a/4b, 5b, 7b, 8a). Their structures were elucidated by comprehensive spectroscopic analyses, and their absolute configurations were determined by comparison of the experimental and quantum chemical calculations of electronic circular dichroism (ECD) curves. In addition, their neuroprotective effects against H2O2-induced oxidative stress in human neuroblastoma SH-SY5Y cells were investigated. Among them, 4a, 4b, and 8b exhibited moderate neuroprotective activity.