NOVEL CAGE-TYPE AZAPARACYCLOPHANE BEARING CHIRAL BINDING-SITES

被引：36

作者：

MURAKAMI, Y

OHNO, T

HAYASHIDA, O

HISAEDA, Y

机构：

来源：

JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS | 1991年 / 14期

关键词：

D O I：

10.1039/c39910000950

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

The guest-binding behaviour of a novel cage-type azaparacyclophane, which has been prepared by the reaction of N,N',N'',N'''-tetravalyl-1,6,20,25-tetraaza[6.1.6.1]paracyclophane with N,N',N'',N'''-tetrakis(5-carboxynicotinoyl)-2,11,20,29-tetraaza[3.3.3.3]paracyclophane, was examined in aqueous media and evaluated by a computer-aided molecular modelling study on the basis of molecular mechanics (MM2 and MMP2) and molecular dynamics (AMBER and CHARMM) conformational search.

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页码：950 / 952

页数：3

相关论文

共 25 条

[1] CONFORMATIONAL-ANALYSIS .130. MM2 - HYDROCARBON FORCE-FIELD UTILIZING V1 AND V2 TORSIONAL TERMS [J].

ALLINGER, NL .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (25) :8127-8134

[2] A SPECTROPHOTOMETRIC INVESTIGATION OF THE INTERACTION OF IODINE WITH AROMATIC HYDROCARBONS [J].

BENESI, HA ;

HILDEBRAND, JH .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1949, 71 (08) :2703-2707

[3] CHARMM - A PROGRAM FOR MACROMOLECULAR ENERGY, MINIMIZATION, AND DYNAMICS CALCULATIONS [J].

BROOKS, BR ;

BRUCCOLERI, RE ;

OLAFSON, BD ;

STATES, DJ ;

SWAMINATHAN, S ;

KARPLUS, M .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1983, 4 (02) :187-217

[4] ANALYTICAL OPTICAL RESOLUTION OF BROMOCHLOROFLUOROMETHANE BY ENANTIOSELECTIVE INCLUSION INTO A TAILOR-MADE CRYPTOPHANE AND DETERMINATION OF ITS MAXIMUM ROTATION [J].

CANCEILL, J ;

LACOMBE, L ;

COLLET, A .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (24) :6993-6996

[5] A NOVEL OPTICALLY-ACTIVE HOST - DESIGN, COMPUTER-GRAPHICS, SYNTHESIS, AND DIASTEREOMERIC COMPLEX-FORMATION IN AQUEOUS-SOLUTION [J].

DHARANIPRAGADA, R ;

FERGUSON, SB ;

DIEDERICH, F .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1988, 110 (06) :1679-1690

[6]

DHARANIPRAGADA R, 1987, TETRAHEDRON LETT, V28, P243

[7] 2,2',7,7'-TETRAHYDROXY-1,1'-BINAPHTHYL - A VERSATILE CHIRAL SPACER FOR NOVEL MONOTOPIC AND DITOPIC CYCLOPHANE HOSTS WITH APOLAR BINDING-SITES [J].

DIEDERICH, F ;

HESTER, MR ;

UYEKI, MA .

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1988, 27 (12) :1705-1711

[8] A NEW WATER-SOLUBLE MACROCYCLIC HOST OF THE CYCLOPHANE TYPE - HOST GUEST COMPLEXATION WITH AROMATIC GUESTS IN AQUEOUS-SOLUTION AND ACCELERATION OF THE TRANSPORT OF ARENES THROUGH AN AQUEOUS PHASE [J].

DIEDERICH, F ;

DICK, K .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (26) :8024-8036

[9] CYCLOPIPERAZINES - A NEW APPROACH TO CHIRAL MACROCYCLIC RECEPTORS [J].

LARKINS, HL ;

HAMILTON, AD .

TETRAHEDRON LETTERS, 1986, 27 (24) :2721-2724

[10]

MMURAKAMI Y, 1990, INCLUSION PHENOMENA, P107