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101.
Rafael Y. O. Moreira Davi S. B. Brasil Cláudio N. Alves Giselle M. S. P. Guilhon Lourivaldo S. Santos Mara S. P. Arruda Adolfo H. Müller Patrícia S. Barbosa Alcicley S. Abreu Edilene O. Silva Victor M. Rumjanek Jaime Souza Jr. Albérico B. F. da Silva Regina H. de A. Santos 《International journal of quantum chemistry》2008,108(3):513-520
Julocrotine, N‐(2,6‐dioxo‐1‐phenethyl‐piperidin‐3‐yl)‐2‐methyl‐butyramide, is a potent antiproliferative agent against the promastigote and amastigote forms of Leishmania amazonensis (L.). In this work, the crystal structure of Julocrotine was solved by X‐ray diffraction, and its geometrical parameters were compared with theoretical calculations at the B3LYP and HF level of theory. IR and NMR spectra also have been obtained and compared with theoretical calculations. IR absorptions calculated with the B3LYP level of theory employed together with the 6‐311G+(d,p) basis set, are close to those observed experimentally. Theoretical NMR calculations show little deviation from experimental results. The results show that the theory is in accordance with the experimental data. © 2007 Wiley Periodicals, Inc. Int J Quantum Chem, 2008 相似文献
102.
103.
Javier Garín Enrique Melndez Francisco L. Merchn Pedro Merino Jesús Orduna Toms Tejero 《Journal of heterocyclic chemistry》1990,27(5):1345-1349
The title compounds 3 were synthesized in one step from bisdithiocarbamates 2 , and their structures were confirmed by two independent syntheses. Alkylation and hydrolysis of 3 gives 3,3′-arylenebis(2,4-dioxo-1,2,3,4-tetrahydroquinazolines) 8 . 相似文献
104.
Large dendrimers, noted G(n)-3(n+2)cage, containing 3(n+2) o-carborane cluster cages MeC(2)B(10)H(10) at their peripheries (n = number of generation noted G(n)) have been synthesized by Huisgen-type azide alkyne Cu(I)-catalyzed dipolar "click" cycloaddition reactions (CuAAC) between an o-carborane monomeric cluster containing an ethynyl group and arene-centered azido-terminated dendrimers G(n)-3(n+2)N(3) of generations 0, 1, and 2. Attempts to synthesize higher-generation dendrimers of this family yielded insoluble materials. The carborane dendrimers G(0)-9cage, G(1)-27cage, and G(2)-81cage have been characterized by (1)H, (13)C, (11)B NMR, elemental analysis, matrix-assisted laser desorption/ionization time of flight (MALDI-TOF) mass spectroscopy, and size exclusion chromatography (SEC) showing low polydispersities, dynamic light scattering (DLS) showing hydrodynamic diameters of 5.7 nm for the G(1)-27cage and the 12.9 nm for the G(2)-81cage. These dendrimers are extremely robust thermally, with 10% mass loss temperatures of 411 °C for the G(0)-9cage, 371 °C for the G(1)-27cage, and 392 °C for the G(2)-81cage. They all showed a strong absorption in the UV region peaking at 258 nm, whereas emission spectra of low intensities were observed between 280 and 480 nm. 相似文献
105.
Jaime G. Mayoral Francisco J. Alarcón Tomás F. Martínez Pablo Barranco F. Noriega 《Applied biochemistry and biotechnology》2010,160(1):1-8
A novel end-point fluorimetric procedure based on the use of rhodamine-110-labeled specific substrate was developed to determine
trypsin activities in biological samples. We evaluated the ability of trichloroacetic acid and acetic acid to stop the enzymatic
reaction without hindering the detection of the fluorescence of rhodamine-110 released into the reaction mixture from the
specific substrate (CBZ-l-alanyl-l-arginine)2-rhodamine-110. Trichloroacetic acid decreased markedly the fluorescence of rhodamine-110, even at low concentrations. On
the other hand, the addition of 50 mmol/l acetic acid inactivated efficiently trypsin activity, causing minor effects on rhodamine-110
fluorescence. The proposed procedure was more sensitive than the spectrophotometric end-point method using N-α-benzoyl-dl-arginine-p-nitroanilide as substrate. The possibility of carrying out end-point fluorimetric assays improves the performance of monocell
fluorimeters by setting specific conditions optimal for each enzyme activity independently of the fluorimeter. This method
also allows replicate assays to be conducted simultaneously, resulting in considerable time saving and in increased performance
of low-cost equipment. 相似文献
106.
The adsorption of HSA onto CHI/ALG multilayer assemblies was assessed in situ using QCM-D. It was found that the behavior of HSA on biomaterials surface can be tuned by adjusting parameters of the polyelectrolyte system such as pH, layer number, crosslinker and polymer terminal layer. Our results confirmed the key role of electrostatic interactions during HSA adsorption, since oppositely charged surfaces were more effective in promoting protein adhesion. QCM-D data revealed that crosslinking (CHI/ALG)(5) CHI films allows HSA to become adsorbed in physiological conditions. Our results suggested that the biological potential of biopolymers and the mild conditions of the LbL technique turn these natural nanoassemblies into a suitable choice to be used as pH-sensitive coatings. 相似文献
107.
The nucleophilic addition of both silyl ketene acetals and lithium enolates derived from methyl acetate to chiral non-racemic N-(benzyloxyethyl)nitrones has been studied both experimentally and theoretically. Aromatic nitrones showed lower reactivity that aliphatic nitrones and the addition of the silyl ketene acetal led to lower selectivities than the addition of the corresponding lithium enolate. Whereas low selectivity was obtained for the addition of the silyl ketene acetal, only one diastereomer could be detected in all cases for the addition of lithium enolate to aliphatic nitrones. The synthetic utility of the two chiral auxiliaries employed lies in the preparation of enantiomeric compounds. DFT theoretical calculations confirmed the stepwise mechanism for the addition of silyl ketene acetals to nitrones and are in good agreement with the observed experimental results. 相似文献
108.
Jaime Leonardo Orjuela Chamorro 《Geometriae Dedicata》2014,172(1):47-67
We construct new examples of embedded, complete minimal hypersurfaces in quaternionic hyperbolic space and also some minimal foliations. We introduce fans and construct analytic deformations of bisectors. 相似文献
109.
Margareth S. Alves Jaime E. Muñoz Rivera Mauricio Sepúlveda Octavio P. Vera Villagrán 《Applied Mathematics Letters》2012,25(5):884-889
In this paper we investigate the asymptotic behavior of solutions to the initial boundary value problem for a mixture of two rigid solids modeling temperature and porosity. Our main result is to establish conditions which ensure the analyticity and the exponential stability of the corresponding semigroup. 相似文献
110.
Alfonso Miranda-Molina Agustín López-Munguía María Luisa San Román Jaime Escalante Marco Antonio Leyva Ana María Puebla Edmundo Castillo Laura Álvarez 《Tetrahedron: Asymmetry》2010,21(1):43-50
The monoglucosyl-inositols α-d-glucopyranosyl-(1→4)-4d-myo-inositol 3 and α-d-glucopyranosyl-(1→1)-1d-myo-inositol 4 were synthesized by a combined enzymatic transglucosylation and hydrolysis strategy, using cyclodextrin glucosyl transferase (CGTase) from Thermoanaerobacter sp., followed by hydrolysis with Aspergillus niger glucoamylase. The glucosides were separated by preparative HPLC and fully characterized by extensive 1D and 2D NMR studies. The structure of the regioisomer 4 was confirmed by X-ray crystallography of its perbenzoylated derivative 4a. Both isomers demonstrated in vivo anti-inflammatory activity at comparative levels to corticosterone on mouse ear oedema induced by 12-O-tetradecanoylphorbol-13-acetate (TPA) and in rat hind paw oedema induced by carrageenan. 相似文献