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991.
Zhong‐Quan Zhang Jian‐Chao Chen Xian‐Ming Zhang Zhong‐Rong Li Ming‐Hua Qiu 《Helvetica chimica acta》2008,91(8):1494-1499
Two new spirostanol saponins, (1β,3β,5β,25S)‐spirostan‐1,3‐diol 1‐(β‐D ‐xylopyranoside) ( 1 ) and (1β,3β,5β,25S)‐spirostan‐1,3‐diol 1‐[α‐L ‐rhamnopyranosyl‐(1→2)‐β‐D ‐fucopyranoside] ( 2 ), along with two known compounds, (1β,3β,5β,25S)‐spirostan‐1,3‐diol 1‐[α‐L ‐rhamnopyranosyl‐(1→2)‐β‐D ‐xylopyranoside] ( 3 ) and (1β,3β,4β,5β,25S)‐spirostan‐1,3,4,5‐tetrol 5‐(β‐D ‐glucopyranoside) ( 4 ) were isolated from the whole plant of Reineckia carnea. The structures of the new steroids were determined by detailed analysis of their 1D‐ and 2D‐NMR spectra and chemical methods, and by comparison with spectral data of known compounds. Compounds 3 and 4 were isolated from the genus Reineckia for the first time. 相似文献
992.
Shu‐Wei Tang Ying‐Fei Chang Li‐Li Sun Hao Sun Zhong‐Min Su Rong‐Shun Wang 《International journal of quantum chemistry》2008,108(8):1391-1399
ABSTRACT: Stability and electronic property calculations are performed systematically based on density functional theory at the B3LYP/6‐31G(d) level for Td C28 fullerene and exohedral fluorine and trifluoromethyl derivatives C28F4–n(CF3)n (n = 0,1,2,3,4). All the exohedral derivatives that are on the potential energy surfaces are kinetically stable with large HOMO‐LUMO gaps. Further investigations show that binding energies of C28F4–n(CF3)n (n = 0,1,2,3,4) molecules are positive, suggesting they are thermodynamically stable. An analysis of the π‐orbital axis vector indicates the high strain in Td C28 cage could be greatly released by fluorine and trifluoromethyl decorations. Mulliken charge analysis reveals that adding different electron groups to the Td C28 cage can cause remarkably different charge populations. In addition, from the ionization potential and electron affinity investigations, the C28F4–n(CF3)n (n = 0,1,2,3,4) molecules manifest weak redox properties. © 2008 Wiley Periodicals, Inc. Int J Quantum Chem, 2008 相似文献
993.
994.
CSP分析方法在简化燃烧化学反应系统中的应用 总被引:2,自引:0,他引:2
基于计算奇异摄动(CSP)思想, 对甲烷/空气预混燃烧系统进行分析. CSP将反应空间分裂, 消除刚性; 将单点分析和全局分析相结合, 合理选择主要组分和稳态物质, 使用CSP的特征指数简化方程. 构建了针对甲烷/空气预混燃烧系统的总包15步反应机理, 并利用Sandia实验室的PREMIX软件包对该系统进行分析, 验证了简化机理的准确性, 证实了CSP分析方法在燃烧系统中应用的可靠性和优越性, 并为研究简化燃烧系统的分析提供了一种新的思路. 相似文献
995.
一维链状锰配位聚合物的合成、晶体结构及热稳定性研究 总被引:1,自引:0,他引:1
A manganese coordination polymer, [Mn(C7H2I3O2)2(CH3OH)2]n was synthesized and characterized by the element analysis, IR, TG and single crystal X-ray diffraction structure analysis. The title complex crystallizes in monoclinic system with space group P21/c, a=0.461 66(9) nm, b=1.716 6(3) nm, c=1.647 5(3) nm, β=91.84(3)°, and V=1.305 2(4) nm3, Z=2, R=0.026 2, wR=0.063 4. Each manganese(Ⅱ) ion exists in an octahedral geometry with four O atoms from three different triiodobenzoate groups and two O atoms from two methanol molecules. Two adjacent manganese(Ⅱ) atoms are bridged by two triiodobenzoate groups in bis-monodentate mode, constructing a one-dimensional chain structure along a axis, with the adjacent Mn…Mn distance being 0.461 7(5) nm. Moreover, the weak interactions between the iodine atoms lead to a three-dimensional supramolecular network. CCDC: 666558. 相似文献
996.
Uniform hollow Au@TiO2 core shell spheres with moveable Au nanoparticles were synthesized based on templating against Au@carbon spheres. The diameter of the shell of the Au@TiO2 spheres could be controlled by adjusting the Ti(OC4H9)4 hydrolyzing reaction time or the ratio of Ti(OC4H9)4 to Au@carbon spheres, and the shell thickness of the core-shell spheres can be varied from 25 nm to 40 nm. As prepared hollow Au@TiO2 core-shell spheres display enhanced photocatalytic activity in the initial stage of photocatalytic degradation of methylene blue compared with pure hollow TiO2 spheres and the commercial photocatalyst TiO2(P-25). 相似文献
997.
A facile method for the copper-catalyzed synthesis of N-benzyl-N-phenyl-2-benzothiazolamines was explored. In the presence of CuI, N-phenylbenzothiazolamines was in situ generated from substituted 1-(2-iodophenyl)-3-phenylthioureas, which susequently underwent coupling with benzyl/allyl halides to give the desired N-benzyl/allyl-N-phenyl-2-benzothiazolamines fluently in a one-pot manner. The protocol features easy performance, easily available materials, good yield and broad substrates scope, showing potential synthetic value for the preparation of a variety of biologically or pharmaceutically active compounds. 相似文献
998.
Hui Xu Dr. Shengbo Zhang Xinyuan Zhang Min Xu Dr. Miaomiao Han Prof. Li Rong Zheng Prof. Yunxia Zhang Prof. Guozhong Wang Prof. Haimin Zhang Prof. Huijun Zhao 《Angewandte Chemie (International ed. in English)》2023,62(52):e202314414
The integration of highly active single atoms (SAs) and atom clusters (ACs) into an electrocatalyst is critically important for high-efficiency two-electron oxygen reduction reaction (2e− ORR) to hydrogen peroxide (H2O2). Here we report a tandem impregnation-pyrolysis-etching strategy to fabricate the oxygen-coordinated Fe SAs and ACs anchored on bacterial cellulose-derived carbon (BCC) (FeSAs/ACs-BCC). As the electrocatalyst, FeSAs/ACs-BCC exhibits superior electrocatalytic activity and selectivity toward 2e− ORR, affording an onset potential of 0.78 V (vs. RHE) and a high H2O2 selectivity of 96.5 % in 0.1 M KOH. In a flow cell reactor, the FeSAs/ACs-BCC also achieves high-efficiency H2O2 production with a yield rate of 12.51±0.18 mol gcat−1 h−1 and a faradaic efficiency of 89.4 %±1.3 % at 150 mA cm−2. Additionally, the feasibility of coupling the produced H2O2 and electro-Fenton process for the valorization of ethylene glycol was explored in detail. The theoretical calculations uncover that the oxygen-coordinated Fe SAs effectively regulate the electronic structure of Fe ACs which are the 2e− ORR active sites, resulting in the optimal binding strength of *OOH intermediate for high-efficiency H2O2 production. 相似文献
999.
Fluorous tagged peptides have shown promising features for biomedical applications such as drug delivery and multimodal imaging. The bioconjugation of fluoroalkyl ligands onto cargo peptides greatly enhances their proteolytic stability and membrane penetration via a proposed “fluorine effect”. The tagged peptides also efficiently deliver other biomolecules such as DNA and siRNA into cells via a co-assembly strategy. The fluoroalkyl chains on peptides with antifouling properties enable efficient gene delivery in the presence of serum proteins. Besides intracellular biomolecule delivery, the amphiphilic peptides can be used to stabilized perfluorocarbon-filled microbubbles for ultrasound imaging. The fluorine nucleus on fluoroalkyls provides intrinsic probes for background-free magnetic resonance imaging. Labeling of fluorous tags with radionuclide 18F also allows tracing the biodistribution of peptides via positron emission tomography imaging. This mini-review will discuss properties and mechanism of the fluorous tagged peptides in these applications. 相似文献
1000.
Xiaona Rong Nabila Mehwish Xueming Niu Niteng Zhu Bae Hoon Lee 《Macromolecular bioscience》2023,23(3):2200463
Nowadays, hydrogels-based microneedles (MNs) have attracted a great interest owing to their outstanding qualities for biomedical applications. For the fabrication of hydrogels-based microneedles as tissue engineering scaffolds and drug delivery carriers, various biomaterials have been tested. They are required to feature tunable physiochemical properties, biodegradability, biocompatibility, nonimmunogenicity, high drug loading capacity, and sustained drug release. Among biomaterials, human proteins are the most ideal biomaterials for fabrication of hydrogels-based MNs; however, they are mechanically weak and poorly processible. To the best of the knowledge, there are no reports of xeno-free human protein-based MNs so far. Here, human albumin-based hydrogels and microneedles for tissue engineering and drug delivery by using relatively new processible human serum albumin methacryloyl (HSAMA) are engineered. The resultant HSAMA hydrogels display tunable mechanical properties, biodegradability, and good biocompatibility. Moreover, the xeno-free HSAMA microneedles display a sustained drug release profile and significant mechanical strength to penetrate the model skin. In vitro, they also show good biocompatibility and anticancer efficacy. Sustainable processible human albumin-based biomaterials may be employed as a xeno-free platform in vivo for tissue engineering and drug delivery in clinical trials in the future. 相似文献