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1.
2.
7-氮杂-3,6-二氧杂-二环[3.3.0]辛-2-酮类化合物合成的新方法 总被引:1,自引:0,他引:1
5-甲氧基-2-(5H)-呋喃酮与氮酸硅烷基酯通过1,3-偶极环加成反应可以为7-氮杂-4-甲氧基-3,6-二氧杂-二环[3.3.0]辛-2-酮类化合物提供新的合成途径。通过元素分析、IR、^1HNMR、^13CNMR、MS等波谱分析进行了结构表征。 相似文献
3.
The complexes [Te(etu)4][SiF6] (1), [Te(etu)4][SiF6] · H2O (2), [Te(trtu)4][SiF6] (3), [Te(etu)4][GeF6] · H2O (4), [Te(trtu)4][GeF6] (5) and [Te(etu)4][SnF6] (6) (etu = ethylenethiourea, trtu = trimethylenethiourea) have been prepared and their crystal structures determined by X-ray crystallographic methods. The crystals of 1, 3 and 5 are tetragonal; space groups P4cc (No. 103) with Z = 4 for 1, P4nc (No. 104) with Z = 2 for 3, and I4 (No. 79) with Z = 2 for 5. The crystals of 2, 4 and 6 are orthorhombic, space group Pccn (No. 56) with Z = 8 for 2 and 4 and Z = 4 for 6; those of 2 and 4 being isomorphous. The cations contain square planar or slightly distorted square planar TeS4 coordination groups. In 1, 3 and 5 the Te atoms are located on fourfold rotation axes; the cations have fourfold rotational symmetry and the four thiourea ligands extend to the same side of the TeS4 plane. These are the first examples of [TeL4]2+ conformers of this type. In 2 and 4 the Te atoms lie on general positions; the cations are distorted versions of those in 1, and also in these the four ligands extend to the same side of the TeS4 plane. In 6 the Te atoms are located on twofold rotation axes, the conformation of the cations corresponds to the point group C2 with two neighbouring ligands extending to one side of the coordination plane and the remaining two to the opposite side. In 1–5 each of the four ligands forms a N–HF bond to the same F atom in the counter ion. The crystals of 1–5 are red, and those of 6 are yellow. The red colour is attributed to interactions of Te and S lone electron pairs caused by ligand TeS4/TeSC tilt angles markedly different from 90°. 相似文献
4.
Investigation of carbon-13 nuclear magnetic resonance spectra-structure correlation based on novel atomic distance-edge (ADE) vector 总被引:1,自引:0,他引:1
A set of novel graph-theoretical parameters,called the atomic distance-edge (ADE) vector,was developed.Based on the connecting C-C bond number between central carbon atom and the other ones,various carbon atoms of alkanes were classified as four types,i.e.,type 1,2,3 and 4 for primary,secondary,ternary and quaternary carbon,respectively; and then four regression equations were obtained to link carbon-13 chemical shift (CS) of each type of atoms.Furthermore,these regression models were used to predict the carbon-13 nuclear magnetic resonance spectra of alkanes and it was found that the estimated CS were in agreement with the experimental results. 相似文献
5.
The exact residues within severe acute respiratory syndrome coronavirus (SARS-CoV) S1 protein and its receptor, human ACE2, involved in their interaction still remain largely undetermined. Identification of exact amino acid residues that are crucial for the interaction of S1 with ACE2 could provide working hypotheses for experimental studies and might be helpful for the development of antiviral inhibitor. In this paper, a molecular docking model of SARS-CoV S1 protein in complex with human ACE2 was constructed. The interacting residue pairs within this complex model and their contact types were also identified. Our model, supported by significant biochemical evidence, suggested receptor-binding residues were concentrated in two segments of S1 protein. In contrast, the interfacial residues in ACE2, though close to each other in tertiary structure, were found to be widely scattered in the primary sequence. In particular, the S1 residue ARG453 and ACE2 residue LYS341 might be the key residues in the complex formation. 相似文献
6.
Aromatic peptide nucleic acid analogs having an N-(2-aminobenzyl)glycine backbone (APNA 1) were previously identified as promising new leads for the design of polyaromatic DNA mimics. Structural modifications of 1, which lock the aromatic backbone into a unique conformation, while maintaining the same space distribution between the nucleobases as in 1, were investigated. The electrostatic potential of the aromatic backbone was also modified in an attempt to improve the solubility of these compounds in aqueous media and to evaluate how the quadrapole of the aromatic backbone may influence the biophysical properties of the APNA oligomers. PNA hexamers containing a single monomer insert of each new APNA monomer were used to explore the hybridization properties of these analogs with poly rA and poly dA. Preliminary results indicated that these modifications do not seriously alter the molecular recognition properties of APNAs towards DNA and RNA. 相似文献
7.
Fernando C. Macedo Jr. 《Tetrahedron letters》2004,45(1):53-55
A novel metabolite from Aspergillus terreus, named terreinol, was isolated and its biosynthetic origin was determined by NMR based on the incorporation of [1-13C]-d-glucose. The labeling pattern indicated a predominant polyketide biosynthetic origin for this metabolite. 相似文献
8.
为了应对新冠病毒肺炎(COVID-19)蔓延和响应教育部"停课不停教,停课不停学"的号召,作者从"两问题三误区"入手分析了现有在线教学存在的问题,并对比了不同直播平台的优缺点,提出了在线教学的具体教学建议。以基于"超星直播+学习通"的在线教学为例进行了教学示范指导。 相似文献
9.
10.
József Reiter László Pongó Tamás Somorai István Pallagi 《Monatshefte für Chemie / Chemical Monthly》1990,121(2-3):173-187
Summary Different functionalized alkyl 3-oxo-butyrates (2) were reacted with 5-amino-3-Q-1H-1,2,4-triazoles (1) to yield3 and4 type 1,2,4-triazolo[1,5-a]pyrimidinones. In case of2 (R
1=methyl,R
2=1-ethoxycarbonylethyl,R
3=ethyl) beside the corresponding derivative4 the unexpected 5,6-dihydro-6,8-dimethyl-7-ethoxycarbonyl-3-methylthio-1,2,4-triazolo[4,3-a]-1,3-diazepin-5(9H)-one (7) was isolated, representing a novel ring system.
Über Triazole, 19. Mitt.: Die Reaktion von 5-Amino-1,2,4-triazolen mit funktionalisierten Acetoessigestern
Zusammenfassung Verschiedene funktionalisierte 3-Oxo-buttersäurealkylester (2) wurden mit 5-Amino-3-Q-1H-1,2,4-triazolen (1) umgesetzt, wobei 1,2,4-Triazolo[1,5-a]pyrimidinone der Typen3 und4 erhalten wurden. Im Fall von2 (R 1=Methyl,R 2=1-Ethoxycarbonylethyl,R 3=Ethyl) wurde neben dem erwarteten Derivat4 das unerwartete 5,6-Dihydro-6,8-dimethyl-7-ethoxycarbonyl-3-me-thylthio-1,2,4-triazolo[4,3-a]-1,3-diazepin-5(9H)-on (7) isoliert, welches ein neues Ringsystem darstellt.相似文献