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【期刊论文】Comparative Study of Activities between Verbascoside and Rutin by Docking Method
高坤, Kun Gaoa, b, B o Tao Fan*a, Nadia El Fassia, Krystyna Zakrzewskac, Zhongjian Jiab, Rongliang Zhengd, Annick Panayea, T. Couesnona, and Jean-Pierre Douceta
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-1年11月30日
Verbascoside and rutin possess anti-cancer properties and are capable of repairing DNA damaged by oxygen radicals, acting as powerful antioxidants. Based on kinetic measurements and experiments on tumor cells, docking studies of the two ligand molecules with the receptor telomeric DNA fragments have been carried out. The docking calculations performed using JUMNA software showed that the both molecules can be docked into the minor groove of telomeric DNA and form complexes with suitable geometry for electron transfer between guanine radicaland ligands. The reaction mechanism via the electron transfer process is further confirmed through energy calculations for transition states using MOPAC 93 program. Complexes can be formed without major distortion of DNA structure and are further stabilized by the interaction of DNA with the saccharide side-groups. By comparing their energies, the difference of activities of the two compounds can be explained.
Verbascoside, Rutin, Biological activity, Telomeric Fragment, Docking study
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【期刊论文】Two New Diterpene Acetylxylosides from Aster veitchianus
高坤, Er Wei LI, Kun GAO*, Zhong Jian JIA*
Chinese Chemical Letters Vol. 15, No. 4, pp 425-427, 2004,-0001,():
-1年11月30日
Two new acetylxylosides, ent-manool-13-O-β-D-2'-acetylxylopyranoside (1) and entmanool 13-O-β-D-2', 4'-diacetylxylopyranoside (2) were isolated from Aster veitchianus. Their structures were elucidated by spectroscopic methods.
Aster veitchianus,, Compositae,, diterpene,, xylosides.,
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【期刊论文】A New Stigmasterol and a New Eremophilenolide from Ligularia dolichobotrys
高坤, Er Wei LI, Kun GAO*, Zhong Jian JIA*
Chinese Chemical Letters Vol.15, No.2, pp 194-196, 2004,-0001,():
-1年11月30日
A new stigmasterol 3β, 7α, 22-trihydoxystigmast-5-ene (1) and a new eremophilenolide 8α-methoxy-6β-angeloyloxyeremophil-7(11)-en-8β, 12-olide-14-oic acid (2) were isolated from Ligularia dolichobotrys Diels. Their structures were deduced on the basis of spectral data.
Ligularia dolichobotrys Diels,, Compositae,, stigmasterol,, eremophilanolide.,
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【期刊论文】Bieremoligularolide and eremoligularin, two novel sesquiterpenoids from Ligularia muliensis
高坤, Qiu-Hong Wua, Chun-Ming Wangb, Sheng-Gao Chenga and Kun Gaoa, *
Tetrahedron Letters 45(2004)8855-8858,-0001,():
-1年11月30日
From the roots of Ligularia muliensis, a novel bieremophilanolide and a new eremophilanolide have been isolated and their structures were elucidated by spectroscopic techniques, including HRMS, IR, UV, 1D-NMR, 2D-NMR, and CD spectra.
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【期刊论文】New Eremophilenolides from Ligulariopsis shichuana
高坤, Wenshu Wang, Kun Gao, and Zhongjian Jia*
J. Nat. Prod. 2002, 65, 714-717,-0001,():
-1年11月30日
Four new eremophilenolides, 1-4, have been isolated from the whole plant of Ligulariopsis shichuana. Their structures were elucidated by spectroscopic methods, including 2D NMR experiments. Structures of compounds 1 and 2 were unequivocally established by X-ray diffraction experiments. All of these sesquiterpenes have eremophilane skeletons with 7(11)-en-8(12) lactone units. Compounds 1 and 2 showed moderate antibacterial activities against E. coli and B. subtilis.
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