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https://www.readbyqxmd.com/read/27920934/crystal-structure-of-3-2-hy-droxy-eth-yl-2-methyl-sulfanyl-6-nitro-3h-benzimidazol-1-ium-chloride-monohydrate
#1
Akoun Abou, Siomenan Coulibali, Rita Kakou-Yao, T Jérémie Zoueu, A Jules Tenon
In the cation of the title hydrated molecular salt, C10H12N3O3S(+)·Cl(-)·H2O, the benzimidazolium ring system is almost planar (r.m.s. deviation = 0.006 Å) and the nitro group is inclined at an angle of 4.86 (9)° to this plane. In the crystal, C-H⋯O hydrogen bonds form centrosymmetric R2(2)(20) dimers and these are further aggregated through N-H⋯O and O-H⋯Cl hydrogen bonds involving the water mol-ecules and chloride anions. Aromatic π-π stacking inter-actions are also found between two parallel benzene rings or the benzene and imidazolium rings, with centroid-centroid distances of 3...
September 1, 2016: Acta Crystallographica. Section E, Crystallographic Communications
https://www.readbyqxmd.com/read/27920932/solvent-inclusion-in-the-crystal-structure-of-bis-adamantan-1-yl-methanaminium-chloride-1-4-dioxane-hemisolvate-monohydrate-explained-using-the-computed-crystal-energy-landscape
#2
Sharmarke Mohamed
Repeated attempts to crystallize 1-adamantane-methyl-amine hydro-chloride as an anhydrate failed but the salt was successfully crystallized as a solvate (2C11H20N(+)·2Cl(-)·0.5C4H8O2·H2O), with water and 1,4-dioxane playing a structural role in the crystal and engaging in hydrogen-bonding inter-actions with the cation and anion. Computational crystal-structure prediction was used to rationalize the solvent-inclusion behaviour of this salt by computing the solvent-accessible voids in the predicted low-energy structures for the anhydrate: the global lattice-energy minimum structure, which has the same packing of the ions as the solvate, has solvent-accessible voids that account for 3...
September 1, 2016: Acta Crystallographica. Section E, Crystallographic Communications
https://www.readbyqxmd.com/read/27920927/synthesis-and-crystal-structure-of-e-2-e-4-hy-droxynaphthalen-1-yl-methyl-idene-hydrazin-1-yl-methyl-sulfan-yl-methyl-idene-azanium-hydrogen-sulfate-monohydrate
#3
Oussama Nehar, Samira Louhibi, Leila Boukli-Hacene, Thierry Roisnel
In the title hydrated mol-ecular salt, C13H14N3S(+)·HSO4(-)·H2O, the protonation of the azomethine N atom in sulfuric acid medium involves the formation of the bis-ulfate anion. The mol-ecular structure of the cation is obtained from the thiol tautomer of thio-semicarbazone wherein the naphthalene moiety and the conjugation of the bonds contribute to the planarity of the mol-ecular skeleton. In the crystal, the cation, anion and water mol-ecule of crystallization are linked by a series of O-H⋯O and N-H⋯O hydrogen bonds, forming a three-dimensional network...
September 1, 2016: Acta Crystallographica. Section E, Crystallographic Communications
https://www.readbyqxmd.com/read/27920908/crystal-structure-of-tris-4-4-bi-pyridine-diium-bis-1-1-3-3-tetra-cyano-2-eth-oxy-propenide-trihydrate
#4
Fatima Setifi, Arto Valkonen, Zouaoui Setifi, Sami Nummelin, Rachid Touzani, Christopher Glidewell
The title hydrated salt, C30H26N6(2+)·2C9H5N4O(-)·3H2O, was obtained as an unexpected product from the hydro-thermal reaction between potassium 1,1,3,3-tetra-cyano-2-eth-oxy-propenide, 4,4'-bi-pyridine and iron(II) sulfate hepta-hydrate. The cation lies across a twofold rotation axis in the space group I2/a with the other components all in general positions. In the cation, the H atom linking the pyridine units is disordered over two adjacent sites having occupancies of 0.66 (4) and 0.36 (4), i.e. as N-H⋯N and N⋯H-N...
September 1, 2016: Acta Crystallographica. Section E, Crystallographic Communications
https://www.readbyqxmd.com/read/27919736/effect-of-morin-5-sulfonic-acid-sodium-salt-on-the-expression-of-apoptosis-related-proteins-caspase-3-bax-and-bcl-2-due-to-the-mercury-induced-oxidative-stress-in-albino-rats
#5
Rantham Subramaniam Venkatesan, Abdul Majeeth Mohamed Sadiq
Many environmental contaminants have been reported to disturb the pro-oxidant or antioxidant balance of the cells by inducing oxidative stress. Oxidative stress mediated by the HgCl2 induces DNA, protein and lipid oxidation resulted in necrosis or apoptosis, or both. Currently flavonoids are being emerging topic and reported to have antiviral, anti-inflammatory, anti- tumor and antioxidant activities. Morin is one of the flavonoid protects the cells from oxygen free radical damage and scavenges the free radicals and metals and also heals the injured cells commercially...
December 2, 2016: Biomedicine & Pharmacotherapy, Biomédecine & Pharmacothérapie
https://www.readbyqxmd.com/read/27919558/do-salt-and-low-temperature-impair-metal-treatment-in-stormwater-bioretention-cells-with-or-without-a-submerged-zone
#6
Laila C Søberg, Maria Viklander, Godecke-Tobias Blecken
Although seasonal temperature changes and (road) salt in winter and/or coastal stormwater runoff might interfere with the metal treatment performance of stormwater bioretention cells, no previous study has evaluated the effect of these factors and their interactions under controlled conditions. In this 18week long study 24 well established pilot-scale bioretention columns were employed to evaluate the individual and combined effect(s) of low/high temperature, salt and presence of a submerged zone with an embedded carbon source on metal removal using a three factor, two-level full factorial experimental design...
December 2, 2016: Science of the Total Environment
https://www.readbyqxmd.com/read/27918296/crystal-structures-of-deprotonated-nucleobases-from-an-expanded-dna-alphabet
#7
Mariko F Matsuura, Hyo Joong Kim, Daisuke Takahashi, Khalil A Abboud, Steven A Benner
Reported here is the crystal structure of a heterocycle that implements a donor-donor-acceptor hydrogen-bonding pattern, as found in the Z component [6-amino-5-nitropyridin-2(1H)-one] of an artificially expanded genetic information system (AEGIS). AEGIS is a new form of DNA from synthetic biology that has six replicable nucleotides, rather than the four found in natural DNA. Remarkably, Z crystallizes from water as a 1:1 complex of its neutral and deprotonated forms, and forms a `skinny' pyrimidine-pyrimidine pair in this structure...
December 1, 2016: Acta Crystallographica. Section C, Structural Chemistry
https://www.readbyqxmd.com/read/27918048/nitrogen-doped-graphene-oxide-for-effectively-removing-boron-ions-from-seawater
#8
Fuming Chen, Lu Guo, Xiaoming Zhang, Zhi Yi Leong, Shengyuan Yang, Hui Ying Yang
Elemental boron exists in the form of boric acid or borate salts in aqueous solution. The human body is very sensitive to the amount of boron, and boron contamination in drinking water affects our health adversely. However, boron is not easily removed due to its small ionic size and is a problem to water treatment systems. Herein, we report a new method to remove boron using nitrogen-doped graphene oxide (N-GO). The maximum adsorption capacity we have obtained is 58.7 mg g(-1) and this makes N-GO one of the best materials to adsorb boron...
December 5, 2016: Nanoscale
https://www.readbyqxmd.com/read/27916693/comparison-of-2-strategies-to-enhance-pyridoclax-solubility-nanoemulsion-delivery-system-versus-salt-synthesis
#9
A-C Groo, M De Pascale, A-S Voisin-Chiret, S Corvaisier, M Since, A Malzert-Fréon
Pyridoclax is an original oligopyridine lead, very promising in treatment of chemoresistant cancers. However, from solubility measurement and permeability evaluation, it appeared that this compound can be considered as a BCS II drug, with a poor water solubility. To overcome this unfavorable property, two strategies were proposed and compared: pyridoclax di-hydrochloride salt synthesis and formulation of pyridoclax-loaded nanoemulsions (PNEs) efficiently performed by transposing the spontaneous emulsification process previously developed by our team...
December 1, 2016: European Journal of Pharmaceutical Sciences
https://www.readbyqxmd.com/read/27916312/effects-of-pulse-and-press-additions-of-salt-on-biofilms-of-nutrient-rich-streams
#10
Joaquín Cochero, Magdalena Licursi, Nora Gómez
Chronic and pulse increments of salinity can cause different consequences on the aquatic communities, and its effects are related to factors such as the magnitude, frequency and ionic composition, as well as on the baseline salt concentrations in the water. The aim of this study was to explore the responses of the biofilms from a nutrient-rich stream to both pulse and chronic additions of salt, along with their recovery after the stressor had been removed. For this purpose, a microcosm study was conducted exposing biofilms to water enriched with sodium chloride in two treatments (press and pulse), and comparing the changes in the biofilm with control microcosms without salt additions...
December 1, 2016: Science of the Total Environment
https://www.readbyqxmd.com/read/27914859/fine-and-ultrafine-atmospheric-particulate-matter-at-a-multi-influenced-urban-site-physicochemical-characterization-mutagenicity-and-cytotoxicity
#11
Yann Landkocz, Frédéric Ledoux, Véronique André, Fabrice Cazier, Paul Genevray, Dorothée Dewaele, Perrine J Martin, Capucine Lepers, Anthony Verdin, Lucie Courcot, Saâd Boushina, François Sichel, Maurizio Gualtieri, Pirouz Shirali, Dominique Courcot, Sylvain Billet
Particulate Matter (PM) air pollution is one of the major concerns for environment and health. Understanding the heterogeneity and complexity of fine and ultrafine PM is a fundamental issue notably for the assessment of PM toxicological effects. The aim of this study was to evaluate mutagenicity and cytotoxicity of a multi-influenced urban site PM, with or without the ultrafine fraction. For this purpose, PM2.5-0.3 (PM with aerodynamic diameter ranging from 0.3 to 2.5 μm) and PM2.5 were collected in Dunkerque, a French coastal industrial city and were extensively characterized for their physico-chemical properties, including inorganic and organic species...
November 30, 2016: Environmental Pollution
https://www.readbyqxmd.com/read/27913018/potential-impact-of-flowback-water-from-hydraulic-fracturing-on-agricultural-soil-quality-metal-metalloid-bioaccessibility-microtox-bioassay-and-enzyme-activities
#12
Season S Chen, Yuqing Sun, Daniel C W Tsang, Nigel J D Graham, Yong Sik Ok, Yujie Feng, Xiang-Dong Li
Hydraulic fracturing has advanced the development of shale gas extraction, while inadvertent spills of flowback water may pose a risk to the surrounding environment due to its high salt content, metals/metalloids (As, Se, Fe and Sr), and organic additives. This study investigated the potential impact of flowback water on four representative soils from shale gas regions in Northeast China using synthetic flowback solutions. The compositions of the solutions were representative of flowback water arising at different stages after fracturing well establishment...
November 29, 2016: Science of the Total Environment
https://www.readbyqxmd.com/read/27912028/formation-and-persistence-of-brine-on-mars-experimental-simulations-throughout-the-diurnal-cycle-at-the-phoenix-landing-site
#13
E Fischer, G M Martínez, N O Rennó
In the last few years, water ice and salts capable of melting this ice and producing liquid saline water (brine) have been detected on Mars. Moreover, indirect evidence for brine has been found in multiple areas of the planet. Here, we simulate full diurnal cycles of temperature and atmospheric water vapor content at the Phoenix landing site for the first time and show experimentally that, in spite of the low Mars-like chamber temperature, brine forms minutes after the ground temperature exceeds the eutectic temperature of salts in contact with water ice...
December 2, 2016: Astrobiology
https://www.readbyqxmd.com/read/27910815/in-vitro-and-in-vivo-evaluations-of-a-novel-post-electrospinning-treatment-to-improve-the-fibrous-structure-of-chitosan-membranes-for-guided-bone-regeneration
#14
Hengjie Su, Kwei-Yu Liu, Anastasios Karydis, Daniel G Abebe, Chaoxi Wu, Kenneth M Anderson, Najib Ghadri, Pradeep Adatrow, Tomoko Fujiwara, Joel D Bumgardner
Electrospun chitosan membranes have been investigated for guided bone regeneration but are susceptible to swelling, dissolution, and loss of biomimetic nanofiber structure due to residual acid salts. A novel process was investigated for acidic salt removal from chitosan electrospun in 70% trifluoroacetic acid (TFA) by treating with triethylamine (TEA)/acetone and di-tert-butyl dicarbonate (tBOC) instead of the common Na2CO3 treatment. TFA salt removal and nanofiber structure stabilization were confirmed by EDS, FTIR, (19)F NMR and electron microscopy before and after soaking in water...
December 2, 2016: Biomedical Materials
https://www.readbyqxmd.com/read/27908484/maintenance-fluid-therapy-isotonic-versus-hypotonic-solutions
#15
REVIEW
Bernie Hansen, Alessio Vigani
The goal of maintenance fluid therapy in small animals is to replace normal ongoing losses of water and salts when oral intake is withheld. Hospitalized dogs and cats may have multiple stimuli for antidiuretic hormone release that disrupt normal osmoregulation and predispose to water retention. Severe illness promotes retention of both sodium and water as edema. Commercially available fluids have electrolyte concentrations that are very different from dietary maintenance requirements, and potential consequences include development of hypoosmolality, edema, or both when excesses of water or sodium are administered...
November 28, 2016: Veterinary Clinics of North America. Small Animal Practice
https://www.readbyqxmd.com/read/27908102/solubility-of-nacl-in-water-and-its-melting-point-by-molecular-dynamics-in-the-slab-geometry-and-a-new-bk3-compatible-force-field
#16
Jiří Kolafa
Saturated concentration of rock salt in water is determined by a simulation of brine in contact with a crystal in the slab geometry. The NaCl crystals are rotated to expose facets with higher Miller indices than [001] to brine. The rock salt melting point is obtained by both the standard and adiabatic simulations in the slab geometry with attention paid to finite size effects as well as to a possible influence of facets with higher Miller indices and applied stress. Two force fields are used, the Lennard-Jones-based model by Young and Cheatham with SPC/E water and the Kiss and Baranyai polarizable model with BK3 water...
November 28, 2016: Journal of Chemical Physics
https://www.readbyqxmd.com/read/27907868/purification-of-high-purity-glycyrrhizin-from-licorice-using-hydrophilic-interaction-solid-phase-extraction-coupled-with-preparative-reversed-phase-liquid-chromatography
#17
Wenyi Yu, Hongli Jin, Aijin Shen, Liang Deng, Jianlian Shi, Xingya Xue, Yadong Guo, Yanfang Liu, Xinmiao Liang
Glycyrrhizin (GA), a major bioactive compound in licorice, has been extensively used throughout the world as a medicine to treat chronic viral hepatitis and allergic dermatitis. In this study, a new method based on hydrophilic interaction solid phase extraction (HILIC-SPE) and preparative reversed-phase liquid chromatography (prep-RPLC) was developed to purify GA with high purity from the complex licorice extract. Via evaluation of retention behavior of GA and flavonoids in different commercially available columns, a hydrophilic column--Click XIon was finally chosen for the purification due to its excellent resolution toward GA and flavonoids under HILIC mode...
November 23, 2016: Journal of Chromatography. B, Analytical Technologies in the Biomedical and Life Sciences
https://www.readbyqxmd.com/read/27904416/adsorption-characteristics-of-different-adsorbents-and-iron-iii-salt-for-removing-as-v-from-water
#18
Josip Ćurko, Marin Matošić, Vlado Crnek, Višnja Stulić, Ivan Mijatović
The aim of this study is to determine the adsorption performance of three types of adsorbents for removal of As(V) from water: Bayoxide(®) E33 (granular iron(III) oxide), Titansorb(®) (granular titanium oxide) and a suspension of precipitated iron(III) hydroxide. Results of As(V) adsorption stoichiometry of two commercial adsorbents and precipitated iron(III) hydroxide in tap and demineralized water were fitted to Freundlich and Langmuir adsorption isotherm equations, from which adsorption constants and adsorption capacity were calculated...
June 2016: Food Technology and Biotechnology
https://www.readbyqxmd.com/read/27904274/pretreatment-of-ferulic-acid-protects-human-dermal-fibroblasts-against-ultraviolet-a-irradiation
#19
Hyung Jin Hahn, Ki Bbeum Kim, Seunghee Bae, Byung Gon Choi, Sungkwan An, Kyu Joong Ahn, Su Young Kim
BACKGROUND: Approximately 90%~99% of ultraviolet A (UVA) ray reaches the Earth's surface. The deeply penetrating UVA rays induce the formation of reactive oxygen species (ROS), which results in oxidative stress such as photoproducts, senescence, and cell death. Thus, UVA is considered a primary factor that promotes skin aging. OBJECTIVE: Researchers investigated whether pretreatment with ferulic acid protects human dermal fibroblasts (HDFs) against UVA-induced cell damages...
December 2016: Annals of Dermatology
https://www.readbyqxmd.com/read/27903312/more-than-two-thirds-of-dietary-iodine-in-children-in-northern-ghana-is-obtained-from-bouillon-cubes-containing-iodized-salt
#20
Abdul-Razak Abizari, Susanne Dold, Roland Kupka, Michael B Zimmermann
OBJECTIVE: Bouillon cubes are widely consumed by poor households in sub-Saharan Africa. Because their main ingredient is salt, bouillon cubes could be a good source of iodine if iodized salt is used in their production and if their consumption by target groups is high. Our objective was to measure the iodine content of bouillon cubes, estimate their daily intake in school-aged children and evaluate their potential contribution to iodine intakes. DESIGN: In a cross-sectional study, we measured urinary iodine concentrations (UIC) and estimated total daily iodine intakes...
December 1, 2016: Public Health Nutrition
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