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1.
Phytochemistry ; 220: 114015, 2024 Apr.
Artigo em Inglês | MEDLINE | ID: mdl-38364884

RESUMO

Eight structurally diverse components, including six undescribed ones, (±)-daphuarin A (1a/1b), daphuarin B (2), daphuarin D-E (4-6), together with a pair of new natural products (±)-daphuarin C (3a/3b) were isolated from the herb of Daphne bholua Buch.-Ham. ex D. Don. Their planar structures were elucidated by extensive spectroscopic analyses. The configurations were established with the assistance of quantum chemical calculations, together with the Custom DP4+ method. The inhibitory potentials of all isolates against acetylcholinesterase were evaluated.


Assuntos
Daphne , Daphne/química , Daphne/metabolismo , Estrutura Molecular , Acetilcolinesterase/metabolismo
2.
J Cosmet Dermatol ; 23(2): 525-528, 2024 Feb.
Artigo em Inglês | MEDLINE | ID: mdl-37641585

RESUMO

BACKGROUND: UV rays not only cause oxidative damage to the skin, but also damage its barrier function. The use of sunscreen is crucial in preventing skin from UV radiation, but it may have an impact on the function of the skin barrier. While much research has focused on the protective effects of sunscreen against UV oxidative damage, little is known about the impact of daily sunscreen use on the skin barrier. OBJECTIVE: This study mainly investigated the changes in skin barrier function of volunteers (including those with sensitive skin) before and after using a ceramide-containing sunscreen. METHODS: A total of 60 volunteers used SPF30 sunscreen containing ceramide every morning. Using non-invasive methods to detect skin barrier changes in TEWL, hydration, facial redness based on VISIA-CR image, and Erythema index (EI) value after 4 weeks of using ceramide-containing sunscreen. Adverse reactions were also assessed. RESULTS: After 4 weeks of using ceramide-containing sunscreen, significant reductions were observed in skin redness with both an 11.89% decrease in a* value and a 5.68% decrease in skin EI, while there was also a significant decrease in transepidermal water loss (TEWL) with a reduction of 22.96%, and a significant increase in skin hydration with a 21.96% increase in the moisture content of the stratum corneum. No adverse events occurred during the entire testing process. CONCLUSION: Daily application of ceramide-containing sunscreen can increase skin hydration while enhancing the function of the skin barrier.


Assuntos
Ceramidas , Protetores Solares , Humanos , Pele , Epiderme , Água
3.
Phytochemistry ; 209: 113614, 2023 May.
Artigo em Inglês | MEDLINE | ID: mdl-36804187

RESUMO

Fractionation motivated by biological activity screening and NMR characteristic signals analysis led to the isolation of seventeen diarylpentanoids from the whole plant of Daphne bholua Buch.-Ham. ex D. Don, among which nine compounds were undescribed. Their structures and stereochemistry were determined by comprehensive spectroscopic data, J-based configurational analysis, and quantum chemical calculations. The inhibitory potentials of all isolates against acetylcholinesterase were evaluated in vitro and in silico.


Assuntos
Daphne , Daphne/química , Daphne/metabolismo , Estrutura Molecular , Acetilcolinesterase/metabolismo , Espectroscopia de Ressonância Magnética
4.
Bioorg Chem ; 129: 106208, 2022 12.
Artigo em Inglês | MEDLINE | ID: mdl-36272251

RESUMO

The genus Daphne is a treasure-house of secondary metabolites with various biological effects, which inspired Daphne bholua being fully investigated phytochemically and biologically for the first time. Here, seven undescribed guaiane-type sesquiterpenoids (1-7) along with thirteen known analogues (8-20) were targeted and isolated from D. bholua using molecular networking. Their chemical structure and configurations were established via NMR spectroscopy analysis, NMR and ECD calculations, Snatzke's method, along with single-crystal X-ray diffraction technique. Moreover, two pairs of sesquiterpene isomers, either with prominent biological properties or with unprecedented skeleton, were revised by means of computer-assisted structure elucidation, chemical shift calculator using deep learning, etc. The inhibitory potentials of all isolates against acetylcholinesterase were evaluated in vitro and in silico.


Assuntos
Inibidores da Colinesterase , Daphne , Sesquiterpenos de Guaiano , Acetilcolinesterase/química , Daphne/química , Estrutura Molecular , Sesquiterpenos de Guaiano/química , Sesquiterpenos de Guaiano/isolamento & purificação , Sesquiterpenos de Guaiano/farmacologia , Inibidores da Colinesterase/química , Inibidores da Colinesterase/isolamento & purificação , Inibidores da Colinesterase/farmacologia
5.
Fitoterapia ; 161: 105250, 2022 Sep.
Artigo em Inglês | MEDLINE | ID: mdl-35798062

RESUMO

Three undescribed acylated sucroses (1-3), one undescribed butenolide analog (4) along with three known compounds (5-7) were isolated from the aqueous EtOH extract of the dried leaves of Tripterygium wilfordii. Their structures were elucidated on the basis of spectroscopic analyses, electron circular dichroism (ECD) techniques, and saccharide hydrolysis. All the isolated compounds were tested for their anti-tyrosinase effects. Among them, 6 exhibited similar inhibitory effects on tyrosinase with IC50 values of 0.073 mM comparing to arbutin. Additionally, the possible mechanism of the interaction between 6 and the active site of tyrosinase was explored by molecular docking.


Assuntos
Monofenol Mono-Oxigenase , Tripterygium , 4-Butirolactona/análogos & derivados , Simulação de Acoplamento Molecular , Estrutura Molecular , Tripterygium/química
6.
PLoS One ; 15(1): e0227609, 2020.
Artigo em Inglês | MEDLINE | ID: mdl-31935238

RESUMO

In order to quantitatively analyze the influence of different traffic conditions on highway crash risk, a method of crash risk assessment based on traffic safety state division is proposed in this paper. Firstly, the highway crash data and corresponding traffic data of upstream and downstream are extracted and processed by using the matched case-control method to exclude the influence of other factors on the model. Secondly, considering the weight of traffic volume, speed and occupancy, a multi-parameter fusion cluster method is applied to divide traffic safety state. In addition, the quantitative relationship between different traffic states and highway crash risk is analyzed by using Bayesian conditional logistic regression model. Finally, the results of case study show that different traffic safety conditions are in different crash risk levels. The highway traffic management department can improve the safety risk management level by focusing on the prevention and control of high-risk traffic safety conditions.


Assuntos
Acidentes de Trânsito/prevenção & controle , Medição de Risco/métodos , Acidentes de Trânsito/estatística & dados numéricos , Condução de Veículo/estatística & dados numéricos , Teorema de Bayes , Planejamento Ambiental , Humanos , Modelos Logísticos , Medição de Risco/estatística & dados numéricos , Segurança , Gestão da Segurança/estatística & dados numéricos
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