Month: November 2021

Recently I am researching about GINKGO-BILOBA; TERPENE TRILACTONES; IDENTIFICATION; CHEMISTRY; GLYCINE; ACID, Saw an article supported by the National Institutes of HealthUnited States Department of Health & Human ServicesNational Institutes of Health (NIH) – USA [R35 GM122606]; Uehara Memorial FoundationUehara Memorial Foundation; Eli LillyEli Lilly; NovartisNovartis; BristolMyers SquibbBristol-Myers Squibb; AmgenAmgen; Boehringer-IngelheimBoehringer Ingelheim; Sloan FoundationAlfred P. Sloan Foundation; Baxter Foundation; NATIONAL INSTITUTE OF GENERAL MEDICAL SCIENCESUnited States Department of Health & Human ServicesNational Institutes of Health (NIH) – USANIH National Institute of General Medical Sciences (NIGMS) [R35GM122606] Funding Source: NIH RePORTER. Published in NATURE PUBLISHING GROUP in LONDON ,Authors: Baker, MA; Demoret, RM; Ohtawa, M; Shenvi, RA. The CAS is 89-91-8. Through research, I have a further understanding and discovery of Methyl 2,2-dimethoxyacetate. HPLC of Formula: C5H10O4

The Ginkgo biloba metabolite bilobalide is widely ingested by humans but its effect on the mammalian central nervous system is not fully understood(1-4). Antagonism of gamma-aminobutyric acid A receptors (GABA(A)Rs) by bilobalide has been linked to the rescue of cognitive deficits in mouse models of Down syndrome(5). A lack of convulsant activity coupled with neuroprotective effects have led some to postulate an alternative, unidentified target(4); however, steric congestion and the instability of bilobalide(1,2,6) have prevented pull-down of biological targets other than the GABA(A)Rs. A concise and flexible synthesis of bilobalide would facilitate the development of probes for the identification of potential new targets, analogues with differential selectivity between insect and human GABA(A)Rs, and stabilized analogues with an enhanced serum half-life(7). Here we exploit the unusual reactivity of bilobalide to enable a late-stage deep oxidation that symmetrizes the molecular core and enables oxidation states to be embedded in the starting materials. The same overall strategy may be applicable to G. biloba congeners, including the ginkgolides-some of which are glycine-receptor-selective antagonists(8). A chemical synthesis of bilobalide should facilitate the investigation of its biological effects and its therapeutic potential.

HPLC of Formula: C5H10O4. About Methyl 2,2-dimethoxyacetate, If you have any questions, you can contact Baker, MA; Demoret, RM; Ohtawa, M; Shenvi, RA or concate me.

Reference:
Patent; U C B, Societe Anonyme; US4041077; (1977); A;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

An article A Highly Stable Triazole-Functionalized Metal-Organic Framework Integrated with Exposed Metal Sites for Selective CO2 Capture and Conversion WOS:000511268600001 published article about CARBON-DIOXIDE CAPTURE; SECONDARY BUILDING UNITS; TOPOLOGICAL ANALYSIS; CRYSTAL-STRUCTURES; CHEMICAL FIXATION; GAS-ADSORPTION; SEPARATION; DESIGN; CONSTRUCTION; CHEMISTRY in [Gupta, Vijay; Mandal, Sanjay K.] Indian Inst Sci Educ & Res Mohali, Dept Chem Sci, Sect 81,Manauli PO, Mohali 140306, Punjab, India in 2020, Cited 73. COA of Formula: C10H11NO4. The Name is Dimethyl 5-aminoisophthalate. Through research, I have a further understanding and discovery of 99-27-4

A new triazole-functionalized tetracarboxylic acid ligand (H4L) has been synthesized and utilized for the fabrication of a 3D Zn-II organic framework with a Zn-4(-COO)(6) cluster as the secondary building unit. The framework exhibits very good thermal stability and consists of dual functionalities of exposed Lewis acidic metal sites and accessible nitrogen-donor Lewis basic sites. The Lewis basic nitrogen sites in the framework serve as CO2 binding sites for highly selective CO2 capture and the presence of exposed Lewis acidic metal sites in the framework make it an efficient heterogeneous catalyst for the chemical fixation of CO2 into value-added cyclic carbonates under ambient conditions.

COA of Formula: C10H11NO4. About Dimethyl 5-aminoisophthalate, If you have any questions, you can contact Gupta, V; Mandal, SK or concate me.

Reference:
Patent; ASTRA ZENECA AB; NPS PHARMACEUTICALS, INC.; WO2004/14881; (2004); A2;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Authors Tang, HJ; Zhang, B; Xue, F; Feng, C in AMER CHEMICAL SOC published article about ALKENES in [Tang, Hai-Jun; Zhang, Bin; Feng, Chao] Nanjing Tech Univ, Sch Chem & Mol Engn, Tech Inst Fluorochem TIF, Inst Adv Synth, Nanjing 211816, Peoples R China; [Xue, Fei] Nanjing Forestry Univ, Coll Sci, Inst Mat Phys & Chem, Nanjing 210037, Peoples R China in 2021, Cited 37. Quality Control of Dimethyl 5-aminoisophthalate. The Name is Dimethyl 5-aminoisophthalate. Through research, I have a further understanding and discovery of 99-27-4

An unprecedented approach for assembling a broad range of 1,2-diarylethane derivatives with fluorine-containing fully substituted carbon centers was developed. The protocol features straightforward operation, proceeds under metal-free condition, and accommodates a large variety of synthetically useful functionalities. The critical aspect to the success of this novel transformation lies in using aryldiazonium salts as both aryl radical progenitor and also as single electron acceptor which elegantly enables a radical-polar crossover manifold.

Quality Control of Dimethyl 5-aminoisophthalate. About Dimethyl 5-aminoisophthalate, If you have any questions, you can contact Tang, HJ; Zhang, B; Xue, F; Feng, C or concate me.

Reference:
Patent; ASTRA ZENECA AB; NPS PHARMACEUTICALS, INC.; WO2004/14881; (2004); A2;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

In 2020.0 EUR J ORG CHEM published article about OXIDATIVE COUPLING REACTION; FACILE SYNTHESIS; C-H; COPPER; AMINOOXYGENATION; DIAMINATION; ANALOGS; KETONES; ACTIVATION; ANNULATION in [Liu, Zhen; Shi, Min] East China Univ Sci & Technol, Sch Chem & Mol Engn, Key Lab Adv Mat, Meilong Rd 130, Shanghai 200237, Peoples R China; [Liu, Zhen; Shi, Min] East China Univ Sci & Technol, Sch Chem & Mol Engn, Inst Fine Chem, Meilong Rd 130, Shanghai 200237, Peoples R China; [Zhang, Yan-Shun; Wei, Yin; Shi, Min] Univ Chinese Acad Sci, Shanghai Inst Organ Chem, State Key Lab Organometall Chem, Chinese Acad Sci,Ctr Excellence Mol Synth, 345 Lingling Rd, Shanghai 200032, Peoples R China in 2020.0, Cited 41.0. The Name is Methyl 3-phenylpropionate. Through research, I have a further understanding and discovery of 103-25-3. Safety of Methyl 3-phenylpropionate

Polysubstituted imidazolinones were synthesized in a facile metal-free cascade nucleophilic cyclization of easily available amidines and 2-substituted acrylates. This protocol is distinguished by simple, mild, and catalyst-free reaction conditions with a broad substrate scope, affording the desired products in moderate to good yields and providing an efficient strategy for synthesis of polysubstituted imidazolinone.

Safety of Methyl 3-phenylpropionate. About Methyl 3-phenylpropionate, If you have any questions, you can contact Liu, Z; Zhang, YS; Wei, Y; Shi, M or concate me.

Reference:
Patent; SANOFI; US2011/294788; (2011); A1;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Application In Synthesis of Methyl 3-phenyl-2-propenoate. Recently I am researching about PROVIDES INSIGHTS; GREEN TEA; POLYPHENOLS; EXPRESSION; EVOLUTION; FINDER; GENES, Saw an article supported by the National Program on the Key Basic Research Project of China [2018YFD1000601]; Huazhong Agricultural University Scientific & Technological Self-Innovation Foundation; German Ministry of Education and ResearchFederal Ministry of Education & Research (BMBF) [FKZ 031B0779A-B]. Published in AMER CHEMICAL SOC in WASHINGTON ,Authors: Qiu, HJ; Zhu, X; Wan, HL; Xu, L; Zhang, QH; Hou, PY; Fan, ZQ; Lyu, Y; Ni, DJ; Usadel, B; Fernie, AR; Wen, WW. The CAS is 103-26-4. Through research, I have a further understanding and discovery of Methyl 3-phenyl-2-propenoate

As one of the most popular beverages globally, tea has enormous economic, cultural, and medicinal importance that necessitates a comprehensive metabolomics study of this species. In this study, a large-scale targeted metabolomics analysis on two types of leaf tissues of nine tea cultivars from five representative geographical origins within China was carried out using the liquid chromatography-mass spectrometry technique. RNA-seq-based transcriptomic analysis was in parallel conducted on the same samples, and gene expression and metabolic differentiation between tissues as well as between the multiple tea cultivars were investigated. The data obtained provide an accessible resource for further studies of naturally occurring metabolic variation of tea plants, which will aid in thoroughly interpreting the underlying genetic and molecular mechanisms of biosynthesis of specialized metabolites in this critical species. Candidate genes including a transcription factor (CsMYB5-like), which were highly correlated with both the content of flavonoids and the expression level of genes participating in the phenylpropanoid and flavonoid biosynthesis pathway, were identified as potential targets for quality improvement of tea.

Application In Synthesis of Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Qiu, HJ; Zhu, X; Wan, HL; Xu, L; Zhang, QH; Hou, PY; Fan, ZQ; Lyu, Y; Ni, DJ; Usadel, B; Fernie, AR; Wen, WW or concate me.

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

An article Aldehydes as potential acylating reagents for oxidative esterification by inorganic ligand-supported iron catalysis WOS:000480643800027 published article about AEROBIC OXIDATION; BUILDING-BLOCKS; ALCOHOLS; ESTERS; TRANSFORMATION; CONVERSION; COMPLEXES; HEME in [Yu, Han; Wei, Yongge] Tsinghua Univ, Dept Chem, Key Lab Organ Optoelect & Mol Engn, Minist Educ, Beijing 100084, Peoples R China; [Yu, Han; Wang, Jingjing; Wu, Zhikang; Zhao, Qixin; Dan, Demin; Han, Sheng] Shanghai Inst Technol, Sch Chem & Environm Engn, 100 Haiquan Rd, Shanghai 201418, Peoples R China; [Tang, Jiangjiang] Northwest A&F Univ, Coll Sci, Shaanxi Engn Ctr Bioresource Chem & Sustainable U, Yangling 712100, Shaanxi, Peoples R China; [Wei, Yongge] Peking Univ, State Key Lab Nat & Biomimet Drugs, Beijing 100191, Peoples R China in 2019.0, Cited 48.0. The Name is Methyl 3-phenylpropionate. Through research, I have a further understanding and discovery of 103-25-3. Formula: C10H12O2

The oxidative esterification of various aldehydes with alcohols could be achieved by a heterogeneous iron(iii) catalyst supported on a ring-like POM inorganic ligand under mild conditions, affording the corresponding esters, including several drug molecules and natural products, in high yields. ESI-MS and control experiments demonstrated that POM-Fe-V(O) was the active catalytic species and the plausible mechanism was presented. More importantly, the 6th run of the iron catalyst recycles shows only a slight decrease in the yield.

About Methyl 3-phenylpropionate, If you have any questions, you can contact Yu, H; Wang, JJ; Wu, ZK; Zhao, QX; Dan, DM; Han, S; Tang, JJ; Wei, YG or concate me.. Formula: C10H12O2

Reference:
Patent; SANOFI; US2011/294788; (2011); A1;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

SDS of cas: 99-27-4. In 2020 J ORG CHEM published article about ONE-POT SYNTHESIS; P=C BONDS; PHOSPHORUS; CHEMISTRY; SEPARATION; MOLECULES; CAVITIES in [Pearce, Kyle G.; Crossley, Ian R.] Univ Sussex, Dept Chem, Brighton BN1 9QJ, E Sussex, England in 2020, Cited 79. The Name is Dimethyl 5-aminoisophthalate. Through research, I have a further understanding and discovery of 99-27-4.

The condensation of MeP(SiMe3)(2) with a series of 5-substituted isophthaloyl chlorides (5-R’C6H3-2,6-{C(O)Cl}(2)) affords the diphosphametacyclophanes m-{-C(O)-C6H3-5-R’-(C(O)PMe)}(2) (R’ = I, Me, tBu, Ph, and p-NCC6H4); the analogues m-{-C(O)-C5H3N-(C(O)PMe)}(2) and m-{-C(O)-C6H4-(C(O)PPh)}(2) are similarly obtained in preference to higher oligomers, in contrast to precedent reports. The cyclophanes all adopt butterfly-like conformations in the solid state with the P-organyl substituents adopting mutually exo arrangements. Structural and computational data suggest the nature of the 5-R substituent is key in directing the inter-ring angle and the extent of LUMO stabilization about the diketophophanyl scaffold. The latter is substantiated by UV/vis spectroscopy and cyclic voltammetry, which demonstrate these cyclophanes to be appreciably comparable to the diketophosphanyl systems commonly explored in the context of organic electronic materials; intriguingly, the distinct dikeophosphanyl moieties within the macrocycles appear effectively insulated by the macrocycle geometry, rather than acting as a through-conjugate.

SDS of cas: 99-27-4. About Dimethyl 5-aminoisophthalate, If you have any questions, you can contact Pearce, KG; Crossley, IR or concate me.

Reference:
Patent; ASTRA ZENECA AB; NPS PHARMACEUTICALS, INC.; WO2004/14881; (2004); A2;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Authors Vriza, A; Canaj, AB; Vismara, R; Cook, LJK; Manning, TD; Gaultois, MW; Wood, PA; Kurlin, V; Berry, N; Dyer, MS; Rosseinsky, MJ in ROYAL SOC CHEMISTRY published article about CHARGE-TRANSFER; ORGANIC COCRYSTALS; MOLECULAR-COMPLEX; DESIGN; ANTHRACENE; PYRENE; WILL in [Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Cook, Laurence J. Kershaw; Manning, Troy D.; Gaultois, Michael W.; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Dept Chem, 51 Oxford St, Liverpool L7 3NY, Merseyside, England; [Vriza, Aikaterini; Canaj, Angelos B.; Vismara, Rebecca; Cook, Laurence J. Kershaw; Manning, Troy D.; Gaultois, Michael W.; Berry, Neil; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Mat Innovat Factory, 51 Oxford St, Liverpool L7 3NY, Merseyside, England; [Vriza, Aikaterini; Gaultois, Michael W.; Dyer, Matthew S.; Rosseinsky, Matthew J.] Univ Liverpool, Leverhulme Res Ctr Funct Mat Design, Oxford St, Oxford, England; [Wood, Peter A.] Cambridge Crystallog Data Ctr, 12 Union Rd, Cambridge CB2 1EZ, England; [Kurlin, Vitaliy] Univ Liverpool, Dept Comp Sci, Mat Innovat Factory, Liverpool L69 3BX, Merseyside, England in 2021.0, Cited 81.0. Product Details of 2005-10-9. The Name is 6H-Benzo[c]chromen-6-one. Through research, I have a further understanding and discovery of 2005-10-9

The implementation of machine learning models has brought major changes in the decision-making process for materials design. One matter of concern for the data-driven approaches is the lack of negative data from unsuccessful synthetic attempts, which might generate inherently imbalanced datasets. We propose the application of the one-class classification methodology as an effective tool for tackling these limitations on the materials design problems. This is a concept of learning based only on a well-defined class without counter examples. An extensive study on the different one-class classification algorithms is performed until the most appropriate workflow is identified for guiding the discovery of emerging materials belonging to a relatively small class, that being the weakly bound polyaromatic hydrocarbon co-crystals. The two-step approach presented in this study first trains the model using all the known molecular combinations that form this class of co-crystals extracted from the Cambridge Structural Database (1722 molecular combinations), followed by scoring possible yet unknown pairs from the ZINC15 database (21 736 possible molecular combinations). Focusing on the highest-ranking pairs predicted to have higher probability of forming co-crystals, materials discovery can be accelerated by reducing the vast molecular space and directing the synthetic efforts of chemists. Further on, using interpretability techniques a more detailed understanding of the molecular properties causing co-crystallization is sought after. The applicability of the current methodology is demonstrated with the discovery of two novel co-crystals, namely pyrene-6H-benzo[c]chromen-6-one (1) and pyrene-9,10-dicyanoanthracene (2).

Product Details of 2005-10-9. About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Vriza, A; Canaj, AB; Vismara, R; Cook, LJK; Manning, TD; Gaultois, MW; Wood, PA; Kurlin, V; Berry, N; Dyer, MS; Rosseinsky, MJ or concate me.

Reference:
Article; Zhang, Jian; Shi, Dongdong; Zhang, Haifeng; Xu, Zheng; Bao, Hanyang; Jin, Hongwei; Liu, Yunkui; Tetrahedron; vol. 73; 2; (2017); p. 154 – 163;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Quality Control of Methyl 3-phenyl-2-propenoate. Recently I am researching about SONOGASHIRA COUPLINGS; PD; EFFICIENT; SYSTEM, Saw an article supported by the University of Alicante [VIGROB-316]; Spanish Ministerio de Economia, Industria y Competitividad [CTQ2015-66624-P, PGC2018-096616-B-100]; Generalitat ValencianaGeneralitat ValencianaEuropean Commission [ACIF/2017/211]. Published in WILEY-V C H VERLAG GMBH in WEINHEIM ,Authors: Saavedra, B; Gonzlez-Gallardo, N; Meli, A; Ramn, DJ. The CAS is 103-26-4. Through research, I have a further understanding and discovery of Methyl 3-phenyl-2-propenoate

A versatile and DES-compatible bipyridine palladium complex has been developed as a general pre-catalyst for different cross-coupling reactions (Hiyama, Suzuki-Miyaura, Heck-Mizoroki and Sonogashira) in deep eutectic solvents. Hydrogen bond capacity of the ligand allows to keep the excellent level of results previously obtained in classical organic solvents. Palladium pre-catalyst showed a high catalytic activity for many cross-coupling reactions, demonstrating a great versatility and applicability. Also, this methodology employs sustainable solvents as a reaction medium and highlights the potential of DES as alternative solvents in organometallic catalysis. The catalyst and DES were easily and successfully recycled. The formation of PdNPs in DES has been confirmed by TEM and XPS analysis and their role as catalyst by mercury test. The dynamic coordination of bipyridine-type ligand in the palladium complex formation has been studied via UV/Vis.

Quality Control of Methyl 3-phenyl-2-propenoate. About Methyl 3-phenyl-2-propenoate, If you have any questions, you can contact Saavedra, B; Gonzlez-Gallardo, N; Meli, A; Ramn, DJ or concate me.

Reference:
Article; Weng, Shiue-Shien; Ke, Chih-Shueh; Chen, Fong-Kuang; Lyu, You-Fu; Lin, Guan-Ying; Tetrahedron; vol. 67; 9; (2011); p. 1640 – 1648;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics

Product Details of 2005-10-9. I found the field of Biochemistry & Molecular Biology; Biophysics very interesting. Saw the article Application of quantitative structure-activity relationship analysis on an antibody and alternariol-like compounds interaction study published in 2019.0, Reprint Addresses Jiang, HY (corresponding author), China Agr Univ, Coll Vet Med, 2 Yuanmingyuan Xilu, Beijing 100193, Peoples R China.. The CAS is 2005-10-9. Through research, I have a further understanding and discovery of 6H-Benzo[c]chromen-6-one.

The antigen-antibody interaction determines the sensitivity and specificity of competitive immunoassay for hapten detection. In this paper, the specificity of a monoclonal antibody against alternariol-like compounds was evaluated through indirect competitive ELISA. The results showed that the antibody had cross-reactivity with 33 compounds with the binding affinity (expressed by IC50) ranging from 9.4 ng/mL to 12.0 mu g/mL. All the 33 compounds contained a common moiety and similar substituents. To understand how this common moiety and substituents affected the recognition ability of the antibody, a three-dimensional quantitative structure-activity relationship (3D-QSAR) between the antibody and the 33 alternariol-like compounds was constructed using comparative molecular field analysis (CoMFA) and comparative molecular similarity indices analysis (CoMSIA) methods. The q(2) values of the CoMFA and CoMSIA models were 0.785 and 0.782, respectively, and the r(2) values were 0.911 and 0.988, respectively, indicating that the models had good predictive ability. The results of 3D-QSAR showed that the most important factor affecting antibody recognition was the hydrogen bond mainly formed by the hydroxyl group of alternariol, followed by the hydrophobic force mainly formed by the methyl group. This study provides a reference for the design of new hapten and the mechanisms for antibody recognition.

Product Details of 2005-10-9. About 6H-Benzo[c]chromen-6-one, If you have any questions, you can contact Wang, JY; Peng, T; Zhang, XY; Xie, SL; Zheng, PM; Yao, K; Ke, YB; Wang, ZH; Jiang, HY or concate me.

Reference:
Article; Zhang, Jian; Shi, Dongdong; Zhang, Haifeng; Xu, Zheng; Bao, Hanyang; Jin, Hongwei; Liu, Yunkui; Tetrahedron; vol. 73; 2; (2017); p. 154 – 163;,
Ester – Wikipedia,
Ester – an overview | ScienceDirect Topics