Lasitha, P’s team published research in ChemPhysChem in 2020-07-15 | 112-63-0

ChemPhysChem published new progress about Density functional theory. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Product Details of C19H34O2.

Lasitha, P.; Dasgupta, S.; Naresh Patwari, G. published the artcile< Unraveling the Origin of Differentiable 'Turn-On' Fluorescence Sensing of Zn2+ and Cd2+ Ions with Squaramides>, Product Details of C19H34O2, the main research area is zinc cadmium sensing fluorescence squaramide; density functional calculations; excited state dynamics; ligand-to-metal charge transfer; squaramides; ‘turn-on’ fluorescence sensing.

A squaramide ring conjugated with Schiff-bases decorated with hydroxy and methoxy functional groups differentially senses zinc and cadmium ions, which turn on the fluorescence. The feebly emitting free ligands light up in the presence of zinc and cadmium acetates, with the acetate ion playing a pivotal role as a conjugate anion. The selective and differentiable emission responses for zinc and cadmium ions make these ligands efficient multi-analyte sensing agents. Furthermore, these ligands could be used to differentially sense zinc and cadmium ions even in aqueous environments. The NMR studies reveal marginal differences in the binding of zinc and cadmium ions to the ligands, whereas d. functional theory calculations suggest the different extent of ligand-to-metal charge transfer (LMCT) contributes to the differential behavior. Finally, comparison of the excited-state dynamics of free ligand and the metal complexes reveal the appearance of longer lifetime (∼500-700 ps) component with complexation, due to rigidified mol. skeleton, thereby impeding the non-radiative processes.

ChemPhysChem published new progress about Density functional theory. 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

Liu, Kun’s team published research in Cell Death & Differentiation in 2022-09-30 | 112-63-0

Cell Death & Differentiation published new progress about Apoptosis. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Category: esters-buliding-blocks.

Liu, Kun; Jiang, Liping; Shi, Yulin; Liu, Baiyang; He, Yaomei; Shen, Qiushuo; Jiang, Xiulin; Nie, Zhi; Pu, Jun; Yang, Cuiping; Chen, Yongbin published the artcile< Hypoxia-induced GLT8D1 promotes glioma stem cell maintenance by inhibiting CD133 degradation through N-linked glycosylation>, Category: esters-buliding-blocks, the main research area is GLT8D1 CD133 degradation signaling stem cell hypoxia glioma progression.

Gliomas are the most aggressive primary brain tumors. However, no significant improvement in survival has been achieved with the addition of temozolomide (TMZ) or radiation as initial therapy, although many clin. efforts have been carried out to target various signaling pathways or putative driver mutations. Here, we report that glycosyltransferase 8 domain containing 1 (GLT8D1), induced by HIF-1α under a hypoxic niche, significantly correlates with a higher grade of glioma, and a worse clin. outcome. Depletion of GLT8D1 inhibits self-renewal of glioma stem cell (GSC) in vitro and represses tumor growth in glioma mouse models. GLT8D1 knockdown promotes cell cycle arrest at G2/M phase and cellular apoptosis with or without TMZ treatment. We reveal that GLT8D1 impedes CD133 degradation through the endosomal-lysosomal pathway by N-linked glycosylation and protein-protein interaction. Directly blocking the GLT8D1/CD133 complex formation by CD133N1∼108 (referred to as FECD133), or inhibiting GLT8D1 expression by lercanidipine, suppresses Wnt/β-catenin signaling dependent tumorigenesis both in vitro and in patient-derived xenografts mouse model. Collectively, these findings offer mechanistic insights into how hypoxia promotes GLT8D1/CD133/Wnt/β-catenin signaling during glioma progression, and identify GLT8D1 as a potential therapeutic target in the future.

Cell Death & Differentiation published new progress about Apoptosis. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Category: esters-buliding-blocks.

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

Rehman, Najeeb Ur’s team published research in Molecules in 2022 | 112-63-0

Molecules published new progress about Acacia nilotica. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Safety of (9Z,12Z)-Methyl octadeca-9,12-dienoate.

Rehman, Najeeb Ur; Ansari, Mohd Nazam; Ahmad, Wasim; Amir, Mohd published the artcile< GC-MS Analysis and In Vivo and Ex Vivo Antidiarrheal and Antispasmodic Effects of the Methanolic Extract of Acacia nilotica>, Safety of (9Z,12Z)-Methyl octadeca-9,12-dienoate, the main research area is Acacia nilotica antidiarrheal diarrhea hyperactive gut motility disorder; A. nilotica; Ca++ channel blocker; GC-MC; antispasmodic; phosphodiesterase inhibitor.

This present study evaluated and rationalized the medicinal use of the fruit part of Acacia nilotica methanolic extract The phytochems. were detected using gas chromatog.-mass spectrometry (GC-MS) while the in vivo antidiarrheal test was done using Swiss albino mice. To determine the details of the mechanism(s) involved in the antispasmodic effect, isolated rat ileum was chosen using different ex vivo assays by maintaining a physiol. environment. GC-MS results showed that A. nilotica contained pyrogallol as the major polyphenol present (64.04%) in addition to polysaccharides, polyphenol, amino acid, steroids, fatty acid esters, and triterpenoids. In the antidiarrheal experiment, A. nilotica inhibited diarrheal episodes in mice significantly (p < 0.05) by 40% protection of mice at 200 mg/kg, while 80% protection was observed at 400 mg/kg by the orally administered extract The highest antidiarrheal effect was observed with loperamide (p < 0.01), used as a control drug. In the ex vivo experiments, A. nilotica inhibited completely in increasing concentrations (0.3 to 10 mg/mL) the carbachol (CCh; 1μM) and high K+ (80 mM)-evoked spasms in ileum tissues at equal potencies (p > 0.05), similar to papaverine, a dual inhibitor of the phosphodiesterase enzyme (PDE) and Ca++ channels. The dual inhibitory-like effects of A. nilotica on PDE and Ca++ were further validated when A. nilotica extract (1 and 3 mg/mL)-pre-incubated ileum tissues potentiated and shifted isoprenaline relaxation curves towards lower doses (leftward), similar to papaverine, thus confirming the PDE inhibitory-like mechanism whereas its CCB-like effect of the extract was confirmed at 3 and 5 mg/mL by non-specific inhibition of CaCl2-mediated concentration response curves towards the right with suppression of the maximum peaks, similar to verapamil, used as standard CCB. Thus, this study characterized the chem. composition and provides mechanistic support for medicinal use of A. nilotica in diarrheal and hyperactive gut motility disorders.

Molecules published new progress about Acacia nilotica. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Safety of (9Z,12Z)-Methyl octadeca-9,12-dienoate.

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

McClendon, Eric’s team published research in Tetrahedron Letters in 2009-02-04 | 112-63-0

Tetrahedron Letters published new progress about Cyclization. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Reference of 112-63-0.

McClendon, Eric; Omollo, Ann O.; Valente, Edward J.; Hamme, Ashton T. II published the artcile< Oxonium ion-mediated synthesis of 4-substituted spiro-isoxazolines>, Reference of 112-63-0, the main research area is spiro isoxazoline stereoselective preparation hydroxyalkylisoxazole cyclization oxonium intermediate.

The stereoselective synthesis of 4-bromo-spiro-isoxazolines was achieved in one step through the bromination of various isoxazoles that contain a pendant alc. or carboxylic acid functional group. Isoxazole bromination leads to a bromonium ion intermediate, which opens either by neighboring oxygen lone pair electrons or by intramol. nucleophilic attack. Single X-ray crystal data provide evidence that the two contiguous stereocenters of the spiro-isoxazoline are formed by the anti intramol. attack of the nucleophile relative to bromine, since there is an anti stereochem. relationship between the spirocyclic ring oxygen and the bromine atom.

Tetrahedron Letters published new progress about Cyclization. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Reference of 112-63-0.

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

Nilsson, Jonas W’s team published research in Journal of Medicinal Chemistry in 2003-09-11 | 617-55-0

Journal of Medicinal Chemistry published new progress about Crystal structure. 617-55-0 belongs to class esters-buliding-blocks, and the molecular formula is C6H10O5, Quality Control of 617-55-0.

Nilsson, Jonas W.; Kvarnstroem, Ingemar; Musil, Djordje; Nilsson, Ingemar; Samulesson, Bertil published the artcile< Synthesis and SAR of Thrombin Inhibitors Incorporating a Novel 4-Amino-Morpholinone Scaffold: Analysis of X-ray Crystal Structure of Enzyme Inhibitor Complex>, Quality Control of 617-55-0, the main research area is amino morpholinone scaffold preparation thrombin inhibition crystal; structure activity relationship amino morpholinone scaffold thrombin inhibitor.

A 4-amino-2-carboxymethyl-3-morpholinone structural motif derived from malic acid has been used to mimic D-Phe-Pro in the thrombin inhibiting tripeptide D-Phe-Pro-Arg. The arginine in D-Phe-Pro-Arg was replaced by the more rigid P1 truncated p-amidinobenzylamine (Pab). These new thrombin inhibitors were used to probe the inhibitor binding site of α-thrombin. The best candidate in this series of thrombin inhibitors exhibits an in vitro IC50 of 0.130 μM. Interestingly, the stereochem. of the 4-amino-2-carboxymethyl-3-morpholinone motif is reversed for the most active compounds compared to that of a previously reported 2-carboxymethyl-3-morpholinone series. The X-ray crystal structure of the lead inhibitor cocrystd. with α-thrombin is discussed.

Journal of Medicinal Chemistry published new progress about Crystal structure. 617-55-0 belongs to class esters-buliding-blocks, and the molecular formula is C6H10O5, Quality Control of 617-55-0.

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

Liang, Xianyu’s team published research in Journal of Chromatography A in 2019-02-22 | 3290-92-4

Journal of Chromatography A published new progress about Homo sapiens. 3290-92-4 belongs to class esters-buliding-blocks, and the molecular formula is C18H26O6, Electric Literature of 3290-92-4.

Liang, Xianyu; Liu, Fan; Wan, Yiqun; Yin, Xiaoying; Liu, Weiting published the artcile< Facile synthesis of molecularly imprinted polymers for selective extraction of tyrosine metabolites in human urine>, Electric Literature of 3290-92-4, the main research area is molecularly imprinted polymer tyrosine metabolite extraction urine; Human urine; Molecular imprinted polymer; Selective extraction; Tyrosine metabolites; Ultra-high performance liquid chromatography.

In this study a method is developed for quant. anal. of three potential biomarkers, including 4-hydroxyphenyl acetic acid (PHPAA), 4-hydroxyphenyl lactic acid (PHPLA) and 3,4-hydroxyphenylpropionic acid (PHPA), in human urine. Mol. imprinted polymers (MIPs) as the sample clean up materials were applied to selectively extract these tyrosine metabolites, followed by precise detection using ultra-high performance liquid chromatog. coupled with a fluorescence detector (UHPLC-FLD). The MIP was prepared by precipitation polymerization adopting PHPAA as the template mol., 1-vinylimidazole (1-vinyl) as functional monomer, trimethylolpropane triacrylate (TRIM) as crosslinker, 2-methylpropionitrile (AIBN) as initiator and acetonitrile as a porogen. The mol. recognition properties and selectivity of MIPs were systematically evaluated, of which results demonstrated high selectivity for three analytes in human urine. Parameters affecting the extraction efficiency were further optimized. Under the optimum conditions, the limits of detection of PHPAA, PHPLA, and PHPA were 1.8 × 10-4, 4.7 × 10-5 and 5.8 × 10-5 mmol L-1, resp., and the recoveries were in the range of 75.7%-110.3%. The method described here provided insights into the future development of materials for highly efficient and selective enrichment of targeted substances.

Journal of Chromatography A published new progress about Homo sapiens. 3290-92-4 belongs to class esters-buliding-blocks, and the molecular formula is C18H26O6, Electric Literature of 3290-92-4.

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

Vysotskii, Yu B’s team published research in Teoreticheskaya i Eksperimental’naya Khimiya in 1988 | 112-63-0

Teoreticheskaya i Eksperimental’naya Khimiya published new progress about Basicity. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Formula: C19H34O2.

Vysotskii, Yu. B. published the artcile< Quantum-chemical interpretation of the substituent effect on the pKa of molecules with conjugated bonds using the PPP method>, Formula: C19H34O2, the main research area is substituent effect basicity conjugated heterocycle; quantum chem conjugated heterocycle PPP.

Change in pKa of unsaturated heterocycles induced by functionalization is proportional to the difference in residual π-electron changes in the unsubstituted heterocycle and its conjugate acid at the site of functionalization.

Teoreticheskaya i Eksperimental’naya Khimiya published new progress about Basicity. 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

Lee, Yu-Lin’s team published research in International Journal of Antimicrobial Agents in 2021-09-30 | 112-63-0

International Journal of Antimicrobial Agents published new progress about Anti-HIV agents. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Category: esters-buliding-blocks.

Lee, Yu-Lin; Lin, Kuan-Yin; Cheng, Shu-Hsing; Lu, Po-Liang; Wang, Ning-Chi; Ho, Mao-Wang; Yang, Chia-Jui; Liou, Bo-Huang; Tang, Hung-Jen; Huang, Shie-Shian; Huang, Sung-Hsi; Chen, Tun-Chieh; Lin, Chi-Ying; Lin, Shih-Ping; Lee, Yuan-Ti; Hung, Chien-Ching published the artcile< Dual therapy with dolutegravir plus boosted protease inhibitor as maintenance or salvage therapy in highly experienced people living with HIV>, Category: esters-buliding-blocks, the main research area is dolutegravir protease inhibitor antiHIV agent HIV; Antiretroviral resistance; Dyslipidaemia; Integrase strand transfer inhibitor; Two-drug regimen; Weight gain.

Real-world experience with dolutegravir (DTG) plus boosted protease inhibitor (bPI) as a two-drug regimen is limited for highly experienced HIV-pos. patients with virol. failure or intolerance to antiretroviral therapy. Patients receiving DTG plus bPI between Sept. 2016 and June 2019 at 15 designated hospitals for HIV care in Taiwan were retrospectively included in this study. A standardised case record form was used to collect clin. data. The primary endpoint was virol. response, defined as achieving or maintaining plasma HIV-RNA <50 copies/mL at Week 48. A total of 77 patients were included; 58 (75.3%) had documented genotypic resistance to 1-4 antiretroviral classes. The most commonly used PI was darunavir (87.0%; 67/77). Seven patients (9.1%) had no virol. data at Week 48, including three with loss to follow-up, one severe hyperlipidemia, one renal failure and cardiovascular disease, one superimposed HBV infection and one death from anal cancer. The virol. response rate increased from 59.7% at baseline to 90.9% at Week 24 and 85.7% at Week 48. The only patient (1.3%) with virol. failure at Week 48 had poor adherence and baseline low-level resistance to darunavir with resistance-associated mutations at M46L, I50V and V82A. Compared with baseline, mean total cholesterol increased by 20.1 mg/dL and weight by 2.8 kg at Week 48, while the estimated glomerular filtration rate decreased by 14.4 mL/min/1.73m2 (both P < 0.05). We conclude that a two-drug regimen containing DTG plus bPI was effective in highly-experienced HIV-pos. patients, but metabolic impact and weight gain should be closely monitored. International Journal of Antimicrobial Agents published new progress about Anti-HIV agents. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Category: esters-buliding-blocks.

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

Hernandez-Ruiz, Raquel’s team published research in Chemistry – A European Journal in 2021-09-24 | 623-50-7

Chemistry – A European Journal published new progress about Absorption spectra. 623-50-7 belongs to class esters-buliding-blocks, and the molecular formula is C4H8O3, Recommanded Product: Ethyl 2-hydroxyacetate.

Hernandez-Ruiz, Raquel; Rubio-Presa, Ruben; Suarez-Pantiga, Samuel; Pedrosa, Maria R.; Fernandez-Rodriguez, Manuel A.; Tapia, M. Jose; Sanz, Roberto published the artcile< Mo-Catalyzed One-Pot Synthesis of N-Polyheterocycles from Nitroarenes and Glycols with Recycling of the Waste Reduction Byproduct. Substituent-Tuned Photophysical Properties>, Recommanded Product: Ethyl 2-hydroxyacetate, the main research area is polyheterocycle preparation green chem; nitroarene glycol tandem reduction imine formation intramol cyclization oxidation; dioxomolybdenum complex catalyst waste reuse; N-heterocycles; dioxomolybdenum; nitroaromatics; photophysical properties; reuse of waste.

A catalytic domino reduction-imine formation-intramol. cyclization-oxidation for the general synthesis of a wide variety of biol. relevant N-polyheterocycles, such as quinoxaline- and quinoline-fused derivatives, and phenanthridines, is reported. A simple, easily available, and environmentally friendly dioxomolybdenum(VI) complex has proven to be a highly efficient and versatile catalyst for transforming a broad range of starting nitroarenes involving several redox processes. Not only is this a sustainable, step-economical as well as air- and moisture-tolerant method, but also it is worth highlighting that the waste byproduct generated in the first step of the sequence is recycled and incorporated in the final target mol., improving the overall synthetic efficiency. Moreover, selected indoloquinoxalines have been photophys. characterized in cyclohexane and toluene with exceptional fluorescence quantum yields above 0.7 for the alkyl derivatives

Chemistry – A European Journal published new progress about Absorption spectra. 623-50-7 belongs to class esters-buliding-blocks, and the molecular formula is C4H8O3, Recommanded Product: Ethyl 2-hydroxyacetate.

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

Pandey, A K’s team published research in Indian Perfumer in 2002-06-30 | 112-63-0

Indian Perfumer published new progress about Gas chromatography-mass spectrometry. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Electric Literature of 112-63-0.

Pandey, A. K.; Chowdhury, A. R. published the artcile< Essential oil of Ocimum basilicum L. from Satpura plateau of central India>, Electric Literature of 112-63-0, the main research area is Ocimum oil camphor gas chromatog.

The composition of the volatile oil of O. basilicum L. growing in India determined by GC-MS indicated the presence of 55 compounds, of which 43 were identified constituting 96.78% of the oil. The main compounds were camphor (19.97%), eugenol (14.1%), camphene (8.92%), γ-gurjunene (4.94%), trans-caryophyllene (3.64%), calarene (3.59%), linalool (2.95%), (Z,E)-α-farnesene (2.82%), patchoulene (2.79%), spathulenol (2.7%), myrtenol (2.48%), and viridiflorol (2.06%). O. basilicum containing camphor as a major constituent was reported 1st time from central India.

Indian Perfumer published new progress about Gas chromatography-mass spectrometry. 112-63-0 belongs to class esters-buliding-blocks, and the molecular formula is C19H34O2, Electric Literature of 112-63-0.

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