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The direct reaction between 2-nitroresorcinol and acetaldehyde in alkaline medium yields tetranitro-C1-resorcin[4]arene in a moderate 8.2% overall yield which was characterized by single crystal X-ray crystallography, 1H NMR spectroscopy and electrospray ionization mass spectrometry (ESI-MS). In solution and in the solid state, the product adopts a unique, thermally stable and unprecedented rcct-boat conformation.

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ANTI-STAPHYLOCOCCUS AUREUS ANTIBODY RIFAMYCIN CONJUGATES AND USES THEREOF

The invention provides rF1 antibody antibiotic conjugates and methods of using same.

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Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. I hope my blog about is helpful to your research. Product Details of 3515-49-9

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Olefin Metathesis Catalyst Supported by a Hemilabile NHC Ligand Bearing Polyether Arms: Structure, Activity, and Decomposition

An olefin metathesis catalyst (8) bearing a hemilabile N-heterocyclic carbene (NHC) ligand with four methoxyethoxy arms was synthesized and analyzed by X-ray crystallography and NMR spectroscopy. The solid-state structure of the catalyst reveals that one of the aromatic rings is rotated toward the plane of the NHC heterocycle, which enables one ortho-O?Ru coordination. Ring-closing metathesis (RCM) activity was tested at low catalyst loadings. Catalyst 8 was found to display a significant rate enhancement relative to the commercial catalyst 3 but offered no improvement in turnover numbers (TON). The solid-state structure of the catalyst’s major degradation product (9) in the presence of 1-hexene reveals a dinuclear compound containing a bridging methylidene (Ru-CH2-Ru), indicating that the methoxyethoxy arms may not be strong enough to stabilize the (NHC)RuCl2(?CH2) catalyst resting state.

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Therapeutic agent for hyperlipidemia

The present invention provides a therapeutic agent for hyperlipidemia, which has a novel action mechanism and which contains a farnesoid X receptor (FXR) antagonist as an active ingredient, and a screening method of the antagonist.

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A phenol compound of the green bionic catalytic nitration method (by machine translation)

The invention discloses a phenol compound of the green bionic catalytic nitration method, which belongs to the technical field of organic synthesis. The method provided by the invention is to phenolic compound as raw material, in the phenol compound is dissolved at room temperature in a solvent, adding sodium nitrite, and then the hydrogen peroxide into the reaction solution, at room temperature by adding metal doped Al – MCM – 41 molecular sieve starting reaction, agitating the nitration reaction, then the use of filtering, organic solvent extraction, concentrated under reduced pressure, column chromatography separation to obtain to obtain the target product. The invention method for the nitration of mild reaction conditions, without heating, the operation is convenient, and the product is easy processing. For the phenol compounds green bionic catalytic nitration reaction. (by machine translation)

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Acute toxicity of substituted phenols to Rana japonica tadpoles and mechanism-based quantitative structure-activity relationship (QSAR) study

Acute 12 h and 24 h lethal toxicity (12 h-LC50 and 24 h-LC50) of 31 substituted phenols to Rana japonica tadpoles was determined. Results indicate that toxicity of phenols to tadpoles varied only slightly with length of exposure and the 12-h test could serve as surrogate of the 24-h test. A mechanism-based quantitative structure-activity relationship (QSAR) method was employed and 1-octanol/water partition coefficient (log Kow)-dependent models were developed to study different modes of toxic action. Most phenols elicited their response via a polar narcotic mechanism and an excellent log Kow-dependent model was obtained. Soft electrophilicity and pro-electrophilicity were observed for some phenols and a good log Kow-dependent model was also achieved. Additionally, the significant dissociation of carboxyl on benzoic acid derivatives sharply reduced their toxicity. A statistically robust QSAR model was developed for all studied compounds with the combined application of log Kow, energy of lowest unoccupied orbital (Elumo), heat of formation (HOF) and the first-order path molecular connectivity dices (1Chip).

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Enhanced H-bonding and pi-stacking in DNA: A potent duplex-stabilizing and mismatch sensing nucleobase analogue

X-pyrene is a new nucleic acid duplex stabilizing cytosine analogue that combines enhanced pi-stacking, hydrogen bonding and electrostatic interactions to greatly increase the stability of bulged DNA duplexes and DNA/RNA hybrids. X-pyrene is highly selective for guanine as a partner and duplex stability is reduced dramatically when X-pyrene or a neighboring base is mismatched. An NMR study indicates that the pyrene moiety stacks within the helix, and large changes in fluorescence emission on duplex formation are consistent with this. These favorable properties make X-pyrene a promising cytosine analogue for use in a variety of biological applications.

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Dialkylamino-2,4-dihydroxybenzoic acids as easily synthesized analogues of platensimycin and platencin with comparable antibacterial properties

Function matters more than synthesis: Simple analogues of platensimycin, nanomolar inhibitors of bacterial FabF enzymes, are made in just two-flask reactions from commercially available aldehydes. These readily synthesized analogues are as effective as platensimycin in killing several bacterial strains. Copyright

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Alpha2C adrenoreceptor agonists

In its many embodiments, the present invention relates to a novel class of phenylmorpholine and phenylthiomorpholine compounds useful as alpha2C adrenergic receptor agonists, pharmaceutical compositions containing the compounds, and methods of treatment, prevention, inhibition, or amelioration of one or more diseases associated with the alpha2C adrenergic receptor agonists using such compounds or pharmaceutical compositions.

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The influence of lateral substituents on the mesophase behaviour of banana-shaped mesogens. Part II

New materials are presented, derived from the original banana compounds where the first smectic phases with polar switching (SmCP) were detected. Our results demonstrate that the introduction of lateral substituents on the central ring (F, Cl, CN, NO2, CH3) and/or on the terminal rings (Cl, Br, CH3) can significantly change the mesophase behaviour. The influence of such substituents is much more pronounced than in comparable calamitic compounds. The clearing temperatures are more or less depressed depending on the number, position and type of lateral substituents. In most cases the laterally substituted compounds form SmCPA phases. Of basic and theoretical interest are compounds where substituents (e.g. 4-cyano; 4,6-dichloro) on the central core enhance the bending angle giving rise to polymorphism variants with conventional smectic and nematic phases as well as “banana phases”: N-SmCPA; SmA-SmCPA; SmA-SmC-SmCPA; SmA-SmAPA-SmCPA. The last mentioned phase sequence has not been reported for single compounds up to now. Furthermore, the pool of materials allows us to compare the significant influence of lateral halogen atoms F, Cl, Br on the mesophase behaviour of bent-core mesogens for the first time. Nevertheless, up to now it has not been possible to predict the mesophase behaviour of bent core mesogens on the basis of the molecular architecture. The Royal Society of Chemistry 2005.

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