Comparison of Volatile Organic Compounds of Thymus Vulgaris Using Hydrodistillation and Headspace Solid Phase Microextraction Gas Chromatography Mass Spectrometry

Essential oil of aerial parts of Tymus vulgaris L. from Babaaman montains of Iran were isolated by hydrodistillation with an average oil yield 1.9 w/w%. The components of the oil were identified by gas chromatography mass spectrometry. On a separate experiments the compositions of volatile emission of the plant were studied by headspace solid phase microextraction and gas chromatography mass spectrometry. The tempratures used during the sample preparation were 25°C and 50°C. In order to determine the effect of solvent (water) on the separation, the experiments were done in the presence and absence of distilled water in the extraction vial at the tempratures mentioned above. Ten majour components were obtained in four different experimental headspace solid phase microextraction conditions and the hydrodistillation methods from the plant. Thymol was found to be the most abundant costituent (27.2–73.09%), follwoed by p‐cymene (6.86–31.76%), γ‐terpinene (1.02–9.26%), myrcene (0.05–8.84%), α‐pinene (0.25–6.63%), caryophyllene (3.09–5.56%), thymol methyl ether (0.99–2.97%), thymolacetate (0.11–2.05%), carvacrol (0.49–1.70%) and α‐cadinol (0.38–1.10%).     

Microbial hydroxylation of pregnenolone derivatives

Pregnenolone and pregnenolone acetate were incubated with the fungi Cunninghamella elegans, Rhizopus stolonifer and Gibberella fujikuroi. Incubation of with C. elegans yielded metabolites, 3beta,7beta,11alpha-trihydroxypreg-5-en-20-one, 3beta,6alpha,11alpha,12beta,15beta-pentahydroxypreg-4-en-20-one and 3beta,6beta,11alpha-trihydroxypreg-4-en-20-one, while incubation with G. fujikuroi yielded two known metabolites, 3beta,7beta-dihydroxypregn-5-en-20-one and 6beta,15beta-dihydroxypreg-4-ene-3,20-dione. Metabolites and were found to be new. Fermentation of by C. elegans yielded four known oxidative metabolites, androsta-1,4-diene-3,17-dione, 6beta,15beta-dihydroxyandrost-4-ene-3,17-dione and 11alpha,15beta-dihydroxypreg-4-ene-3,20-dione. Fermentation of with R. stolonifer yielded two known metabolites, 11alpha-hydroxypreg-4-ene-3,20-dione and. Compounds were screened for their cholinesterase inhibitory activity in a mechanism-based assay.     

Fluorometric determination of paraoxon in human serum using a gold nanoparticle-immobilized organophosphorus hydrolase and coumarin 1 as a competitive inhibitor

A dimeric organophosphorus hydrolase (OPH; EC 3.1.8.1; 72 kDa) was isolated from wild-type bacteria, analyzed for its 16s rRNA sequence, purified, and immobilized on gold nanoparticles (AuNPs) to form the transducer part of a biosensor. The isolated strain was identified as Pseudomonas aeruginosa. The AuNPs were characterized by transmission electron microscopy and localized surface plasmon resonance. Covalent binding of OPH to the AuNPs was confirmed by spectrophotometry, enzymatic activity assays, and FTIR spectroscopy. Coumarin 1, a competitive inhibitor of OPH, was used as a fluorogenic probe. The bioconjugates quench the emission of coumarin 1 upon binding, but the addition of paraoxon results in an enhancement of fluorescence that is directly proportional to the concentration of paraoxon. The gold-OPH conjugates were then used to determine paraoxon in serum samples spiked with varying levels of paraoxon. The method works in the 50 to 1,050 nM concentration range, has a low standard deviation (with a CV of 5.7–11 %), and a detection limit as low as 5?×?10^?11 M.

Recent trends in the synthesis of 1,2,3-thiadiazoles

Abstract

1,2,3-Thiadiazoles, structurally active pharmacophores have attracted significant attention of synthetic chemists, medicinal and pharmaceutical researchers because of their versatile biological activities against various diseases such as herbicidal, insecticidal, antiviral, antitumor, antimicrobial, anticancer, plants activator and anti-amoebic activities. A literature survey of the last decade presented in this review article summarizes the major synthetic approaches, methodologies and strategies adopted for the synthesis of 1,2,3-thiadiazole scaffolds which will be help for medicinal chemists and pharmacists in future synthesis and development of novel therapeutic agents.     

A quadratically convergent local algorithm on minimizing sums of the largest eigenvalues of a symmetric matrix

In this paper, we consider the problem on minimizing sums of the largest eigenvalues of a symmetric matrix which depends on the decision variable affinely. An important application of this problem is the graph partitioning problem, which arises in layout of circuit boards, computer logic partitioning, and paging of computer programs. Given 0, we first derive an optimality condition which ensures that the objective function is within error bound of the solution. This condition may be used as a practical stopping criterion for any algorithm solving the underlying problem. We also show that, in a neighborhood of the minimizer, the optimization problem can be equivalently formulated as a smooth constrained problem. An existing algorithm on minimizing the largest eigenvalue of a symmetric matrix is shown to be applicable here. This algoritm enjoys the property that if started close enough to the minimizer, then it will converge quadratically. To implement a practical algorithm, one needs to incorporate some technique to generate a good starting point. Since the problem is convex, this can be done by using an algorithm for general convex optimization problems (e.g., Kelley's cutting plane method or ellipsoid methods), or an algorithm specific for the optimization problem under consideration (e.g., the algorithm developed by Cullum, Donath, and Wolfe). Such union ensures that the overall algorithm has global convergence with quadratic rate. Finally, the results presented in this paper are readily extended on minimizing sums of the largest eigenvalues of a Hermitian matrix.Some of results in this paper were given in [19] without proofs.     

A new modified Laplace decomposition method for higher order boundary value problems

In this article, we suggest modified Laplace decomposition method for analytical solution of eighth-order boundary value problems (BVPs). The numerical application indicates the effectiveness and stability of the proposed algorithm. The efficiency of proposed method is examined with the help of linear and nonlinear problems.     

Heteropolyacid anchored on SBA-15 functionalized with 2-aminoethyl dihydrogen phosphate: a novel and highly efficient catalyst for one-pot,three-component synthesis of trisubstituted 1,3-thiazoles

Heteropolyacid anchored on SBA-15 functionalized with 2-aminoethyl dihydrogen phosphate (SBA-15@AEPH₂-HPA) was synthesized as a novel and highly efficient heterogeneous mesoporous catalyst. Characterization of the as-synthesized catalyst was successfully performed using various techniques such as FT-IR, BET, small-angle XRD, SEM, EDX, TEM, TGA, ICP-OES and elemental analysis. The new catalyst revealed a superb catalytic activity towards the one-pot synthesis of a wide verity of trisubstituted 1,3-thiazole derivatives. This protocol involved the three-component reactions of arylglyoxals, cyclic 1,3-dicarbonyls and thioamides under mild reaction conditions. Surprisingly, the current methodology is far superior to the only literature precedent used in this regard. The most promising features which highlight the presented approach are: furnishing a very important class of pharmaceutically and biologically active 1,3-thiazoles in excellent yields within short reaction times, mildness of the reaction conditions, using water as the reaction media and facile catalyst reusability for at least nine successive runs without any appreciable loss of its activity. Importantly, the small-angle XRD analysis and TEM images of the 9th recovered catalyst clearly proved the privileged durability and stability of the introduced catalytic system, under the applied reaction condition.     

Highly regioselective synthesis of dicyano-8a,10,11-trihydropyrrolo[1,2-α][1,10]phenanthrolines via a domino-Knoevenagel-cyclization

1,10-Phenanthrolinium N-ylides,can react with malonitrile and aromatic aldehydes via a domino-Knoevenagel cyclization to afford a new class of trihydropyrrolo[1,2-a][l,10]phenanthroline derivatives as stable helical compounds in a simple,mild,and efficient protocol in excellent yields.