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七取代磺丁醚-beta-环糊精 | 165133-56-2

七取代磺丁醚-beta-环糊精
4-[[36,37,38,39,40,41,42,43,44,45,46,48,49-Tridecahydroxy-5,15,20,25,30,35-hexakis(hydroxymethyl)-47-(4-sulfobutoxy)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-10-yl]methoxy]butane-1-sulfonic acid
165133-56-2
C50H86O41S2
1407.3233
如需查看该化合物的物化性质、别名、危化属性、合成路线等详细信息,可点击:165133-56-2
七取代磺丁醚-beta-环糊精 数据

Mol:

165133-56-2.mol    by:chem960.com
ChemDraw08031019472D

…………

0 0 0 0
6.6584 -5.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3639 -5.4423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0694 -5.0370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3639 -3.8080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3556 -6.2573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0616 -6.6670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.1840 -5.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8895 -5.4990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5950 -5.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5950 -4.2787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8895 -3.8647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4736 -5.4990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4693 -6.3183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.8813 -3.0455 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.2976 -3.8647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3556 -2.9888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9480 -3.8124 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.9319 -5.4903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
14.7513 -6.9110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8826 -11.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2015 -8.1356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4519 -7.7041 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
-0.7022 -8.1313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0472 -7.6998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7968 -8.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5464 -7.6955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2959 -8.1225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1361 -7.2161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6936 -7.2465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12 20 1 1 0 0 0
39 42 1 1 0 0 0
1 6 1 0 0 0 0
38 43 1 6 0 0 0
36 9 1 1 0 0 0
13 21 1 1 0 0 0
37 44 1 1 0 0 0
45 46 1 0 0 0 0
6 10 1 1 0 0 0
14 22 1 6 0 0 0
15 77 1 1 0 0 0
23 24 1 0 0 0 0
2 3 1 0 0 0 0
1 11 1 6 0 0 0
45 50 1 0 0 0 0
46 47 1 0 0 0 0
47 48 1 0 0 0 0
48 49 1 0 0 0 0
49 50 1 0 0 0 0
12 13 1 0 0 0 0
46 51 1 6 0 0 0
3 4 1 0 0 0 0
51 52 1 0 0 0 0
4 5 1 0 0 0 0
45 53 1 1 0 0 0
5 6 1 0 0 0 0
23 28 1 0 0 0 0
54 55 1 1 0 0 0
24 25 1 0 0 0 0
56 55 1 1 0 0 0
57 58 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 28 1 0 0 0 0
26 29 1 6 0 0 0
57 61 1 0 0 0 0
58 59 1 0 0 0 0
59 60 1 0 0 0 0
60 54 1 0 0 0 0
54 61 1 0 0 0 0
4 7 1 1 0 0 0
59 62 1 6 0 0 0
29 30 1 0 0 0 0
62 63 1 0 0 0 0
56 64 1 0 0 0 0
28 31 1 1 0 0 0
12 17 1 0 0 0 0
23 32 1 1 0 0 0
13 14 1 0 0 0 0
56 68 1 0 0 0 0
64 65 1 0 0 0 0
65 66 1 0 0 0 0
66 67 1 0 0 0 0
67 68 1 0 0 0 0
24 33 1 6 0 0 0
64 69 1 6 0 0 0
25 20 1 1 0 0 0
69 70 1 0 0 0 0
34 35 1 0 0 0 0
68 71 1 6 0 0 0
14 15 1 0 0 0 0
67 72 1 1 0 0 0
66 53 1 1 0 0 0
15 16 1 0 0 0 0
61 73 1 1 0 0 0
16 17 1 0 0 0 0
57 74 1 6 0 0 0
58 31 1 1 0 0 0
7 8 1 0 0 0 0
50 75 1 6 0 0 0
16 18 1 6 0 0 0
49 76 1 1 0 0 0
48 42 1 1 0 0 0
1 2 1 0 0 0 0
2 77 1 6 0 0 0
34 39 1 0 0 0 0
35 36 1 0 0 0 0
78 79 1 0 0 0 0
36 37 1 0 0 0 0
79 80 1 0 0 0 0
37 38 1 0 0 0 0
80 81 1 0 0 0 0
38 39 1 0 0 0 0
81 82 1 0 0 0 0
18 19 1 0 0 0 0
82 83 1 0 0 0 0
34 40 1 6 0 0 0
83 84 1 0 0 0 0
5 9 1 6 0 0 0
79 85 2 0 0 0 0
40 41 1 0 0 0 0
79 86 2 0 0 0 0
M END
七取代磺丁醚-beta-环糊精 Smile 编码: [C@@H]1([C@H]2O[C@@H]3[C@@H](CO)O[C@@H]([C@@H]([C@H]3O)O)O[C@@H]3[C@@H](CO)O[C@H](O[C@@H]4[C@@H](CO)O[C@@H]([C@H](O)[C@H]4O)O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@@H]([C@H]([C@H](O[C@@H]6CO)O[C@@H]([C@@H]1O)[C@@H](CO)O2)O)O)O[C@@H]5CO)O[C@@H]4CO)[C@H](O)[C@H]3O)O.OS(=O)(=O)CCCCO

七取代磺丁醚-beta-环糊精 InChi 编码:

七取代磺丁醚-beta-环糊精 InChiKey 编码:

如果您需要其它格式的数据,比如:Reaction File,JSDraw2 html,CDX,CDXML等格式的文件,您可以使用我们的结构式搜索工具,可以直接进行导出(详情请点击 ); 如果您想了解更多关于七取代磺丁醚-beta-环糊精的物化性质,请参考我们化工词典中收录的词条:七取代磺丁醚-beta-环糊精 如果您有更其他更特殊的定制数据需求,请直接拨打我们的客服热线:4000 025 960 。

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