Solanum elaeagnifolium Var. Obtusifolium (Dunal) Dunal: Antioxidant,Antibacterial, and Antifungal Activities of Polyphenol-Rich Extracts Chemically Characterized by Use of In Vitro and In Silico Approaches

The present work was designed to study the chemical composition and the antioxidant and antimicrobial properties of fruits (SFr) and leaf (SF) extracts from Solanum elaeagnifolium var. obtusifolium (Dunal) Dunal (S. elaeagnifolium). The chemical composition was determined using HPLC-DAD analysis. Colorimetric methods were used to determine polyphenols and flavonoids. Antioxidant capacity was assessed with DPPH, TAC, and FRAP assays. Antimicrobial activity was assessed using disk diffusion and microdilution assays against two Gram (+) bacteria (Staphylococcus aureus ATCC-6633 and Bacillus subtilis DSM-6333) and two Gram (-) bacteria (Escherichia coli K-12 and Proteus mirabilis ATCC-29906), while the antifungal effect was tested vs. Candida albicans ATCC-1023. By use of in silico studies, the antioxidant and antimicrobial properties of the studied extracts were also investigated. HPLC analysis showed that both fruits and leaf extracts from S. elaeagnifolium were rich in luteolin, quercetin, gallic acid, and naringenin. Both SFr and SF generated good antioxidant activity, with IC₅₀ values of 35.15 ± 6.09 μg/mL and 132.46 ± 11.73 μg/mL, respectively. The EC₅₀ of SFr and SF was 35.15 ± 6.09 μg/mL and 132.46 ± 11.73 μg/mL, respectively. SFr and SF also showed a good total antioxidant capacity of 939.66 ± 5.01 μg AAE/and 890.1 ± 7.76 μg AAE/g, respectively. SFr had important antibacterial activity vs. all tested strains—most notably B. subtilis DSM-6333 and E. coli, with MICs values of 2.5 ± 0.00 mg/mL and 2.50 ± 0.00 mg/mL, respectively. SFr demonstrated potent antifungal activity against C. albicans, with an inhibition diameter of 9.00 ± 0.50 mm and an MIC of 0.31 ± 0.00 mg/mL. The in silico approach showed that all compounds detected in SFr and SF had high activity (between −5.368 and 8.416 kcal/mol) against the receptors studied, including NADPH oxidase, human acetylcholinesterase, and beta-ketoacyl-[acyl carrier protein] synthase.     

Electron Ionization Mass Spectra of Organophosphorus Compounds. Part III: Mass Spectrometric Fragmentation of Diethyl Spiro[Pyrimidino[5,3′][1,2]Oxazole] Phosphonate,Diethyl (Oxazolo[5,4-D]Pyrimidine-4,6-Dione)Phosphonate,and Diethyl (Pyrimidino[4,5-B][1,4]Oxazine)Phosphonate Derivatives

Abstract

Fragmentation pathways of 14 organophosphorus compounds derived from diethyl spiro[pyrimidino[5,3][1,2]oxazole] phosphonates, diethyl (oxazolo[5,4-d]pyrimidine-4,6-dione)phosphonates, and diethyl (pyrimidino[4,5-b][1,4] oxazine)phosphonates were investigated by electron impact mass spectrometry (EI-MS). The intensity of the recorded molecular ion peaks showed various values depending on the nature of the compounds. Characteristic fragment ions were formed by successive loss of simple functional groups followed by decomposition of heterocycles connected to pyrimidine rings.     

Decay solution for the renewal equation with diffusion

In this paper we consider age structured equation with diffusion under nonlocal boundary condition and nonnegative initial data. We prove existence, uniqueness and the positivity of the solution to the above problem. Our main result is to get an exponential decay of the solution for large times toward such a study state. To this end we prove a weighted Poincaré–Wirtinger’s type inequality in unbounded domain.     

A Heroin Epidemic Model: Very General Non Linear Incidence,Treat-Age,and Global Stability

The aim of this work is to establish the existence of multi-peak solutions for the following class of quasilinear problems

$$ - \mbox{div} \bigl(\epsilon^{2}\phi\bigl(\epsilon|\nabla u|\bigr)\nabla u \bigr) + V(x)\phi\bigl(\vert u\vert\bigr)u = f(u)\quad\mbox{in } \mathbb{R}^{N}, $$

where \(\epsilon\) is a positive parameter, \(N\geq2\), \(V\), \(f\) are continuous functions satisfying some technical conditions and \(\phi\) is a \(C^{1}\)-function.

     

Some remarks on quasilinear parabolic problems with singular potential and a reaction term

In this paper we deal with the following quasilinear parabolic problem $$\left\{\begin{array}{l@{\quad}l} (u^\theta)_t - \Delta_p {u} = \lambda \frac{u^{p - 1}}{|x|^{p}} + u^q + f,\,\, u \geq 0 \quad {\rm in} \;\;\Omega \times (0, T),\\ u(x, t) = 0 \quad\qquad\qquad\qquad\qquad\qquad\qquad {\rm on}\; \partial \Omega \times(0, T),\\ u(x, 0) = u_0(x), \,\,\, \qquad\qquad\qquad\qquad\qquad x \in\; \Omega,\end{array}\right.$$ where θ is either 1 or (p ? 1), \({N \geq 3, \,\Omega \subset \mathcal{IR}^N}\) is either a bounded regular domain containing the origin or \({\Omega \equiv \mathcal{IR}^N}\) , 1 < p < N, q > 0 and u ₀ ≥  0, f ≥  0 with suitable hypotheses. The aim of this work is to get natural conditions to show the existence or the nonexistence of nonnegative solutions. In the case of nonexistence result, we analyze blow-up phenomena for approximated problems in connection with the classical Harnack inequality, in the Moser sense, more precisely in connection with a strong maximum principle. We also study when finite time extinction (1 < p < 2) and finite speed propagation (p > 2) occur related to the reaction power.     

Synthesis of novel 3-phenyl-2-oxido/sulfido-1,3,4,2-benzoxadiazaphosphepines

An efficient and facile synthetic approach towards a series of novel 3-phenyl-2-oxido/sulfido-2,3-dihydro-1,3,4,2-benzoxadiazaphosphepines 2–7 was described. The method depended on the cyclocondensation of equimolar ratios of salicylaldehyde phenylhydrazone (1) with different examples of phosphorus halides and phosphorus sulfides in toluene containing triethylamine as a catalyst. In the same manner, the fusion of salicylaldehyde phenylhydrazone (1) with triethyl phosphate in the presence of DBU afforded the 2-ethoxy-1,3,4,2-benzoxa-diazaphosphepine 8, while a fusion of compound 1 with diethyl phosphite and tris(2-chloroethyl)phosphite led to the formation of new examples of 1,2-benzoxaphospholes 9 and 10, respectively. Interestingly, the reaction of compound 1 with diethyl ethoxycarbonyl phosphonate in ethanol containing DBU as a catalyst furnished the chromeno[3,4-d][1,2,3]diazaphosphole derivative 12 as a regioselective product.     

Nonintrusive data-based learning of a switched control heating system using POD,DMD and ANN

The aim of this work is to derive an accurate model of two-dimensional switched control heating system from data generated by a Finite Element solver. The nonintrusive approach should be able to capture both temperature fields, dynamics and the underlying switching control rule. To achieve this goal, the algorithm proposed in this paper will make use of three main ingredients: proper orthogonal decomposition (POD), dynamic mode decomposition (DMD) and artificial neural networks (ANN). Some numerical results will be presented and compared to the high-fidelity numerical solutions to demonstrate the capability of the method to reproduce the dynamics.     

Synthetic approach for novel bis(α‐aminophosphonic acid) derivatives of chromone containing 1,2,4,3‐triazaphosphole moieties

Terephthalic acid hydrazide ( 1 ) was reacted with phenylphosphonic dichloride to yield bis(1,3,4,2‐oxadiazaphosphole) derivative 3 , which was condensed with α‐aminophosphonic acid derivative 4 to afford bis[(1,2,4,3‐triazaphospholyl)(chromonyl)methylphosphonic acid] derivative 5 . The addition of diethyl phosphite to Schiff bases 9 and 10 derived from the condensation of bis(4‐amino‐1,2,4,3‐triazaphosphole) derivative 6 or bis(4‐phosphorylamino‐1,2,4,3‐triazaphosphole) derivative 7 with 3‐formyl‐6‐methylchromone ( 8 ) yielded bis[(1,2,4,3‐triazaphospholyl)(chromonyl)aminomethylphosphonate] derivative 11 and bis[(1,2,4,3‐triazaphospholyl)(chromonyl)phosphorylamino‐methylphosphonate] derivative 12 , respectively. The structures of all products were established by elemental analysis and spectral data. © 2009 Wiley Periodicals, Inc. Heteroatom Chem 20:117–122, 2009; Published online in Wiley InterScience ( www.interscience.wiley.com ). DOI 10.1002/hc.20520