Month: November 2022

Zheng, Yun-Dan; Zhong, Tairan; Wu, Haiming; Li, Nan; Fang, Zuye; Cao, Linlin; Yin, Xing-Feng; He, Qing-Yu; Ge, Ruiguang; Sun, Xuesong published the artcile< Crizotinib shows antibacterial activity against Gram-positive bacteria by reducing ATP production and targeting the CTP synthase PyrG>, Product Details of C19H34O2, the main research area is crizotinib antibacterial activity bacteria ATP production CTP synthase PyrG; Gram-positive bacteria; crizotinib; drug repurposing; quantitative proteomics.

Infections caused by drug-resistant bacteria are a serious threat to public health worldwide, and the discovery of novel antibacterial compounds is urgently needed. Here, we screened an FDA-approved small-mol. library and found that crizotinib possesses good antimicrobial efficacy against Gram-pos. bacteria. Crizotinib was found to increase the survival rate of mice infected with bacteria and decrease pulmonary inflammation activity in an animal model. Furthermore, it showed synergy with clindamycin and gentamicin. Importantly, the Gram-pos. bacteria showed a low tendency to develop resistance to crizotinib. Mechanistically, quant. proteomics and biochem. validation experiments indicated that crizotinib exerted its antibacterial effects by reducing ATP production and pyrimidine metabolism A drug affinity responsive target stability study suggested crizotinib targets the CTP synthase PyrG, which subsequently disturbs pyrimidine metabolism and eventually reduces DNA synthesis. Subsequent mol. dynamics anal. showed that crizotinib binding occurs in close proximity to the ATP binding pocket of PyrG and causes loss of function of this CTP synthase. Crizotinib is a promising antimicrobial agent and provides a novel choice for the development of treatment for Gram-pos. infections.

Microbiology Spectrum published new progress about Acetyl-coenzyme A carboxylase inhibitors. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Product Details of C19H34O2.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Zhang, Jun; Wang, Xuefeng; Kuang, Yunyan; Wu, Jie published the artcile< Generation of Sulfonylated Tetrazoles through an Iron-Catalyzed Multicomponent Reaction Involving Sulfur Dioxide>, Computed Properties of 112-63-0, the main research area is cyano sulfonyl tetrazole preparation; cycloketone oxime ester alkyne trimethylsilyl azide multicomponent iron catalyst; Chemistry; Green Chemistry; Organic Chemistry; Organic Synthesis.

Herein, a five-component reaction of cycloketone oxime esters I (X = C, O; Ar = 4-trifluoromethylphenyl), alkynes, R2CCH (R2 = Ph, 1-naphthyl, cyclohex-1-en-1-yl, thiophen-3-yl, etc.) DABCO.(SO2)2, and two mols. of trimethylsilyl azide under iron catalysis is developed, giving rise to a range of cyano-containing sulfonylated tetrazoles II in moderate to good yields. This multicomponent reaction exhibits excellent selectivity and enables the formation of multiple new chem. bonds in one pot. A possible mechanism involving azidosulfonylation of alkynes, C-C bond cleavage of both cycloketone oxime esters I and alkynes, and [3 + 2] cycloaddition of trimethylsilyl azide and the nitrilium cation intermediate is proposed. Addnl., the potential of terminal alkynes acting as powerful synthons for the synthesis of tetrazoles II in a radical initiated process is demonstrated for the first time.

iScience published new progress about [3+2] Cycloaddition reaction. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Computed Properties of 112-63-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Wang, Kui; Ren, Xiao-Wei; Cui, Jian-Hua; Guo, Jia-Shuang; Xing, Si-Yang; Dou, Hong-Xi; Wang, Meng-Meng published the artcile< Multistimuli Responsive Supramolecular Polymeric Nanoparticles Formed by Calixpyridinium and Chondroitin 4-Sulfate>, HPLC of Formula: 112-63-0, the main research area is calixpyridinium chondroitin sulfate supramol polymeric nanoparticle morphol optical property.

We have successfully constructed multistimuli responsive supramol. polymeric nanoparticles based on the complexation of calixpyridinium with polyanionic chondroitin 4-sulfate. The nanoparticles are disassembled upon increasing pH from 6 to 9, while a pH-responsive morphol. conversion from spherical nanoparticles to nanorods is observed upon decreasing pH from 6 to 2. Adding a competitive guest can also disrupt the assembly, representing the host-guest inclusion response. Interestingly, an unexpected hyaluronidase-responsive morphol. conversion from spherical nanoparticles to wire-like suprastructures rather than disassembly is also observed, as a result of the hyaluronidase-induced cleavage of chondroitin 4-sulfate. The multistimuli responsive morphol. conversion property with various dimensions, along with the facile preparation, will make this supramol. polymeric assembly approach well-suitable for a variety of important material applications.

ChemistrySelect published new progress about Aggregation. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, HPLC of Formula: 112-63-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Katagiri, Takayuki; Amao, Yutaka published the artcile< Visible-light-induced enzymatic reactions using an NADH regeneration system of water-soluble zinc porphyrin and homogeneous colloidal rhodium nanoparticles>, COA of Formula: C19H34O2, the main research area is zinc porphyrin rhodium photocatalyst biocatalyst NADH regeneration.

The photo and biocatalyst hybrid system is one of the most ideal artificial photosynthetic systems using solar energy to synthesize various chems. and fuels. This study was devoted to achieving visible-light-driven mol. conversion with various enzymes using the NADH regeneration system consisting of an electron donor such as triethanol amine (TEOA), zinc tetraphenylporphyrin tetrasulfonate (ZnTPPS) as a photosensitizer and colloidal polyvinylpyrrolidone-dispersed rhodium nanoparticles (Rh-PVP) as a catalyst. The irradiation wavelength dependence of NADH regeneration with the system of TEOA, ZnTPPS, Rh-PVP and NAD+ was studied and the quantum efficiency for NADH regeneration at monochromatic 420 nm due to the Soret band of ZnTPPS was estimated to be ca. 0.0012%. This NADH regeneration system was also applied to various enzyme-catalyzed redox reactions. By using this NADH regeneration system in the presence of lactate or D-3-hydroxybutyrate dehydrogenases, various enantioselective mol. conversions by visible-light energy were accomplished. By using this NADH regeneration and malate dehydrogenase (decarboxylating), photo and biocatalytic CO2 fixation to organic mols. based on carbon-carbon bond formation between pyruvate and CO2 has been successfully achieved. The results not only show an example of colloidal metal nanoparticles used as a catalyst for selective NADH regeneration in general artificial photosynthesis but also the selective production of chems./solar fuels directly from CO2 with visible-light energy.

Sustainable Energy & Fuels published new progress about Enzymes Role: BSU (Biological Study, Unclassified), CAT (Catalyst Use), BIOL (Biological Study), USES (Uses). 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, COA of Formula: C19H34O2.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Thakur, Kratima; Khare, Naveen K. published the artcile< Synthesis of glycoconjugate mimics by 'click chemistry'>, HPLC of Formula: 4098-06-0, the main research area is click alkyne azide triazole cycloaddition catalyst preparation; triazole glycoconjugate preparation stereoselective library mol structure; 1,3-Dipolar cycloaddition; Click reaction; CuI; Glycoconjugates; Stereoselectivity.

Stereo-defined 2-deoxy propargyl glycosides can be used for the synthesis of corresponding 1,4-disubstituted sugar derived triazoles by using only CuI and stereo-defined sugar azide derivatives The click chem. which involves copper (I) catalyzed alkyne-azide 1,3-dipolar cycloaddition, was used to prepare a library of glycoconjugates mimics. Different sugar propargyl-2-deoxy-O-α-D-glycopyranoside derivatives and β-glycopyranosyl azide derivatives were coupled using catalyst CuI to yield triazole glycoconjugates. The catalyst CuI (2.5 equivalent) in CH3CN was found to be most efficient for the synthesis of 1,4-disubstituted triazole scaffolds affording up to 94% of optimized yield and with retention of the anomeric configuration of the starting glycosides. The key feature of this methodol. is the absence of sodium L-ascorbate/ascorbic acid which is most active substrate of current research with strong potential for click reactions. In this article, the library of novel stereoselective deoxy sugar derived triazole glycoconjugates have been synthesized and structures were determined by the 1H, 13C & 2D NMR spectroscopy.

Carbohydrate Research published new progress about 1,3-Dipolar cycloaddition reaction. 4098-06-0 belongs to class esters-buliding-blocks, and the molecular formula is C12H16O7, HPLC of Formula: 4098-06-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Borthwick, Alan D.; Foxton, Michael W.; Gray, Brian V.; Gregory, Gordon I.; Seale, Peter W.; Warburton, William K. published the artcile< 2-Nitrothizaoles>, Product Details of C19H34O2, the main research area is nitrothiazole bactericide; thiazole nitro bactericide; oxadiazole nitrothiazolyl bactericide; deamination aminothiazolyloxadiazole nitro Sandmeyer.

2-Nitrothiazole-5-carboxaldehyde oxime (I; R = CH:NOH) with propene oxide and COCl2 gave 60.5% I (R = CN) which with NH2OH gave 69% I [R = C(:NOH)NH2]. The latter with CH(OEt)3 and BF3.Et2O gave 48.5% 3-(2-nitrothiazol-5-yl)-1,2,4-oxadiazole (II; R = NO2, R1 = H). II (R = NH2, R1 = H), prepared in 4 steps from 2-aminothiazole-5-carboxaldehyde, with Cu and HNO2 gave 41% II (R = NO2, R1 = H) and 6% II (R = R1 = H). Similarly II (R = NH2, R1 = Me) gave 25% II (R = NO2, R1 = Me) and 20% II (R = H, R1 = Me). I (R = CHO) with 1,2,4-oxadiazol-3-ylmethyltriphenylphosphonium chloride and its 5-Me derivative gave 58 and 34% oxadizoles (III, R = H, and Me, resp.). The latter 2 compounds and II (R = NO2, R1 = H and Me) showed powerful antibacterial properties.

Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) published new progress about Deamination. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Product Details of C19H34O2.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Jarugu, Lokesh Babu; Reddy, China Anki; Chikkananjunda, Nanjundaswamy Kanikahalli; Krishnamoorthy, Suresh; Sarvanakumar, Pon; Sankar, Ulaganathan; Arunachalam, Pirama Nayagam; McDonald, Ivar M.; Olson, Richard E.; Rampulla, Richard; Mathur, Arvind; Gupta, Anuradha published the artcile< Process Optimization for the Large-Scale Preparation of (2S,3aR,7aS)-tert-Butyl Hexahydro-2,5-methanopyrrolo[3,2-c]pyridine-1(4H)-carboxylate, an Intermediate for Nicotinic Acetylcholine Receptor Agonists>, Formula: C19H34O2, the main research area is process optimization large scale preparation methanopyrrolopyridinecarboxylate; methanopyrrolopyridinecarboxylate preparation monoiodination Sonogashira coupling; one pot debenzylation ring hydrogenation methanopyrrolopyridinecarboxylate preparation.

An optimized large-scale synthesis of (2S,3aR,7aS)-tert-Bu hexahydro-2,5-methanopyrrolo[3,2-c]pyridine-1(4H)-carboxylate (I), an important intermediate for nicotinic acetylcholine receptor agonists, is described starting from the readily available and inexpensive 4-aminopyridine over in 10 steps in an overall yield of 14%. The key feature of the synthesis involves three transformations in a one-pot process, including debenzylation and ring hydrogenation of two fused bicyclic rings. Multihundred gram quantities of I were prepared

Organic Process Research & Development published new progress about Debenzylation. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Formula: C19H34O2.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Dean, Jacob C.; Kusaka, Ryoji; Walsh, Patrick S.; Allais, Florent; Zwier, Timothy S. published the artcile< Plant Sunscreens in the UV-B: Ultraviolet Spectroscopy of Jet-Cooled Sinapoyl Malate, Sinapic Acid, and Sinapate Ester Derivatives>, HPLC of Formula: 617-55-0, the main research area is plant UV B UV spectroscopy jet cold sinapate derivative.

UV spectroscopy of sinapoyl malate, an essential UV-B screening agent in plants, was carried out in the cold, isolated environment of a supersonic expansion to explore its intrinsic UV spectral properties in detail. Despite these conditions, sinapoyl malate displays anomalous spectral broadening extending well over 1000 cm-1 in the UV-B region, presenting the tantalizing prospect that nature’s selection of UV-B sunscreen is based in part on the inherent quantum mech. features of its excited states. Jet-cooling provides an ideal setting in which to explore this topic, where complications from intermol. interactions are eliminated. In order to better understand the structural causes of this behavior, the UV spectroscopy of a series of sinapate esters was undertaken and compared with ab initio calculations, starting with the simplest sinapate chromophore sinapic acid, and building up the ester side chain to sinapoyl malate. This “”deconstruction”” approach provided insight into the active mechanism intrinsic to sinapoyl malate, which is tentatively attributed to mixing of the bright V (1ππ*) state with an adiabatically lower 1nπ* state which, according to calculations, shows unique charge-transfer characteristics brought on by the electron-rich malate side chain. All members of the series absorb strongly in the UV-B region, but significant differences emerge in the appearance of the spectrum among the series, with derivatives most closely associated with sinapoyl malate showing characteristic broadening even under jet-cooled conditions. The long vibronic progressions, conformational distribution, and large oscillator strength of the V (ππ*) transition in sinapates makes them ideal candidates for their role as UV-B screening agents in plants.

Journal of the American Chemical Society published new progress about Ab initio methods. 617-55-0 belongs to class esters-buliding-blocks, and the molecular formula is C6H10O5, HPLC of Formula: 617-55-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Dong, Xiaochen; Su, Ching-Yuan; Zhang, Wenjing; Zhao, Jianwen; Ling, Qidan; Huang, Wei; Chen, Peng; Li, Lain-Jong published the artcile< Ultra-large single-layer graphene obtained from solution chemical reduction and its electrical properties>, HPLC of Formula: 112-63-0, the main research area is ultralarge single layer graphene elec property FET.

Graphene is a promising candidate for making next-generation nanoelectronic devices. Developing methods to produce large sized graphene with high yield is the key for graphene applications. Here, we report a simple method for large-scale production of ultra-large single-layer graphene sheet (≤50 μm) reduced from graphene oxides by hydrazine in the presence of aromatic tetrasodium 1,3,6,8-pyrenetetrasulfonic acid (TPA) which efficiently disperse the resulting graphene sheet in aqueous solutions Field-effect transistors can be readily fabricated using such large reduced graphene oxide sheets. The mobility of the reduced graphene oxide increases with the temperature of subsequent thermal reduction and reaches 3.5 cm2 V-1 s-1 after reduction at 1000°. Such solution-processable method is of great potential in printable fabrication of graphene-based devices.

Physical Chemistry Chemical Physics published new progress about Electric current-potential relationship. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, HPLC of Formula: 112-63-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Smith, Merry K.; Northrop, Brian H. published the artcile< Vibrational Properties of Boroxine Anhydride and Boronate Ester Materials: Model Systems for the Diagnostic Characterization of Covalent Organic Frameworks>, HPLC of Formula: 112-63-0, the main research area is vibrational spectra boroxine anhydride boronate ester.

The vibrational characteristics of 28 different boronic acid, boroxine anhydride, and boronate ester species have been systematically investigated using a combination of exptl. IR spectroscopy and computational modeling. IR bands characteristic to each boron-containing functionality have been categorized and assigned in conjunction with d. functional theory (B3LYP/6-31G(d)), with the aim of better understanding and distinguishing the vibrational characteristics of covalent organic frameworks (COFs) built from boronic acids. In several cases, vibrational assignments differ from those previously reported in the literature on boronic acid-based COFs. Vibrations commonly regarded as diagnostic for one functionality are found in regions of the IR spectrum where other functionalities also show characteristic peaks. The collective exptl. and computational results reveal that several alternative bands in the IR region can be used to more diagnostically distinguish between boronic acid, boroxine anhydride, and boronate ester species. The results presented herein provide the tools for straightforward characterization of boroxine anhydride and boronate ester species using IR spectroscopy. The results can be applied to addnl. theor. studies of larger COF-like assemblies as well as the anal. of other boronic-acid-based materials.

Chemistry of Materials published new progress about Conformational potential. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, HPLC of Formula: 112-63-0.

Referemce:
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics