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皂苷 QA 21V1 | 141256-04-4

皂苷 QA 21V1结构式图片|141256-04-4结构式图片
皂苷 QA 21V1
QS 21
141256-04-4
C92H148O46
1990.13192g/mol
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:141256-04-4
皂苷 QA 21V1 数据

Mol:

141256-04-4.mol    by:chem960.com
ChemDraw08031019472D

…………

02 0.7155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.5489 -0.5284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.1619 4.2596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.5377 4.2817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1067 0.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9757 -4.3037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7022 -3.0709 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-11.6512 2.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-12.3777 1.4420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-10.9467 0.3082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.2642 -0.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.8552 -0.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8220 1.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1176 -0.1652 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2180 -5.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6473 -3.8635 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-12.3336 3.0929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-11.0568 3.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-13.0822 1.8710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.9467 -0.5064 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-11.6620 0.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.2642 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5486 0.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0435 -5.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7446 -5.8008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3186 -4.3369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-13.0822 2.6856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-12.3336 3.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-11.6732 -0.9137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-12.3665 0.2862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2530 1.0676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5486 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7812 -5.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0435 -5.9658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-13.7863 3.0929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.9684 0.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2530 -0.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8773 -0.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3643 -4.7882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.5959 1.1008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.1886 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2530 -1.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.2893 0.6603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0253 -0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8254 -0.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.0598 1.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4875 -0.8477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.7863 0.6603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4271 3.3901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2779 0.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 3 1 0
1 4 1 1
1 5 1 0
2 6 1 0
2 7 1 0
2139 1 6
3 8 1 0
3 9 1 6
4 10 1 0
4 11 2 0
5 12 1 0
6 13 1 0
6 14 2 0
7 15 1 0
8 13 1 0
16 10 1 1
12 15 1 0
13 17 1 0
13 18 1 6
14 19 1 0
15 20 1 0
15 21 1 0
16 22 1 0
16 23 1 0
17 24 1 0
17 25 1 0
17 26 1 1
19 24 1 0
22 27 1 0
22 28 1 6
23 29 1 0
24 30 1 0
25 31 1 0
27 32 1 0
27 33 1 1
34 28 1 6
29 35 1 1
29 32 1 0
30 36 1 0
30 37 1 0
30 38 1 1
31 36 1 0
32 39 1 1
33 40 1 0
34 41 1 0
34 42 1 0
36 43 1 0
36140 1 6
37 44 1 0
40 45 1 0
40 46 2 0
41 47 1 0
41 48 1 1
42 49 1 0
43 50 1 0
43 51 1 6
43 52 1 0
44 50 1 0
45 53 1 0
47 54 1 0
47 55 1 1
49 56 1 1
49 54 1 0
50 57 1 1
51 58 2 0
53 59 1 0
53 60 1 0
54 61 1 6
62 57 1 1
59 63 1 0
64 61 1 6
62 65 1 0
62 66 1 0
63 67 1 0
63 68 1 0
64 69 1 0
64 70 1 0
65 71 1 0
65 72 1 6
66 73 1 0
67 74 1 0
68 75 1 0
68 76 1 0
69 77 1 0
69 78 1 6
70 79 1 0
71 80 1 0
71 81 1 1
82 72 1 1
73 83 1 1
73 80 1 0
74 84 1 0
74 85 2 0
75 86 1 0
77 87 1 1
77 88 1 0
79 88 1 0
80 89 1 6
90 81 1 1
82 91 1 0
82 92 1 0
83 93 1 0
83 94 2 0
84 95 1 0
96 87 1 6
88 97 1 6
90 98 1 0
90 99 1 0
91100 1 0
92101 1 0
92102 1 6
95103 1 0
95104 1 0
96105 1 0
96106 1 0
98107 1 0
98108 1 1
99109 1 0
100110 1 0
100111 1 1
101112 1 1
101110 1 0
103113 1 0
105114 1 0
105115 1 6
106116 1 0
107117 1 0
107118 1 6
109117 1 0
110119 1 1
111120 1 0
113121 1 0
113122 1 0
114123 1 0
114124 1 6
114116 1 0
117125 1 1
126121 1 6
122127 1 0
122128 1 0
123129 1 0
126130 1 0
126131 1 0
127132 1 0
130133 1 0
131134 1 0
131135 1 1
133136 1 1
133134 1 0
134137 1 6
136138 1 0
M END
皂苷 QA 21V1 Smile 编码: [C@@]12(CCC(C)(C)C[C@]1([H])C1=CCC3[C@@]4(C)CC[C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@H](O[C@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@H]5O[C@H]5[C@H](O)[C@H]([C@@H](O)[C@@H](CO)O5)O)C(=O)O)[C@@](C)(C=O)[C@]4([H])CC[C@@]3(C)[C@]1(C)C[C@H]2O)C(=O)O[C@H]1O[C@H]([C@@H](O)[C@@H](OC(=O)CC(O)CC(C(C)CC)OC(=O)CC(O)CC(C(C)CC)O[C@H]2[C@H](O)[C@@H](O)[C@H](CO)O2)[C@@H]1O[C@@H]1O[C@H]([C@H](O[C@H]2OC[C@@H](O)[C@H](O[C@H]3OC[C@](O)(CO)[C@H]3O)[C@H]2O)[C@@H](O)[C@H]1O)C)C

皂苷 QA 21V1 InChi 编码:

皂苷 QA 21V1 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皂苷 QA 21V1的物化性质,请参考我们化工词典中收录的词条:皂苷 QA 21V1 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 。
皂苷 QA 21V1推荐生产厂家

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