缩宫素结构式
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中文名称：缩宫素
英文名称：Oxytocin
CAS No.：
6233-83-6
分子式：C43H66N12O12S2.C2H4O2
分子量：1067.2393
了解价格行情：缩宫素价格
更多厂家：缩宫素厂家
如需查看该化合物的详细物理属性、别名、危化属性、合成路线等，可点击：6233-83-6
缩宫素 数据
Mol:
1.0542 20.5297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6946 21.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 21.3147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 22.8847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 18.1747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 16.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0542 15.8197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
13.7736 15.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7736 14.2497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 13.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.0542 14.2497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.4139 11.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.7736 11.1097 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.0542 11.1097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6946 11.8947 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.3349 11.1097 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.9753 11.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.1332 16.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.4929 15.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
17.8525 16.6047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
19.2122 15.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
19.2122 14.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
20.5719 13.4647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
17.8525 13.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
16.4929 14.2497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
2 4 2 0 0 0 0
5 6 1 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 11 2 0 0 0 0
10 12 1 0 0 0 0
12 13 1 1 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
14 16 1 0 0 0 0
12 17 1 0 0 0 0
17 18 1 0 0 0 0
18 19 2 0 0 0 0
20 18 1 1 0 0 0
20 21 1 0 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 20 1 0 0 0 0
21 25 1 0 0 0 0
25 26 2 0 0 0 0
27 25 1 1 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 30 2 0 0 0 0
29 31 1 0 0 0 0
31 32 1 1 0 0 0
32 33 1 0 0 0 0
33 34 1 0 0 0 0
33 35 2 0 0 0 0
31 36 1 0 0 0 0
36 37 1 0 0 0 0
37 38 2 0 0 0 0
37 39 1 0 0 0 0
39 40 1 6 0 0 0
40 41 1 0 0 0 0
41 42 1 0 0 0 0
42 43 1 0 0 0 0
42 44 2 0 0 0 0
39 45 1 0 0 0 0
45 46 1 0 0 0 0
46 47 2 0 0 0 0
48 46 1 6 0 0 0
48 49 1 0 0 0 0
49 50 1 1 0 0 0
49 51 1 0 0 0 0
51 52 1 0 0 0 0
48 53 1 0 0 0 0
53 54 1 0 0 0 0
54 55 2 0 0 0 0
54 56 1 0 0 0 0
56 57 1 0 0 0 0
57 58 1 0 0 0 0
58 59 2 0 0 0 0
58 60 1 0 0 0 0
60 61 1 1 0 0 0
60 62 1 0 0 0 0
62 63 1 0 0 0 0
63 64 1 0 0 0 0
64 65 1 0 0 0 0
65 27 1 0 0 0 0
56 66 1 6 0 0 0
66 67 1 0 0 0 0
67 68 2 0 0 0 0
68 69 1 0 0 0 0
69 70 2 0 0 0 0
70 71 1 0 0 0 0
70 72 1 0 0 0 0
72 73 2 0 0 0 0
73 67 1 0 0 0 0
M END
如需查看完整mol文件，请联系我们的客服免费获取
缩宫素 Smile 编码:
CC(O)=O.NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@H]1N(CCC1)C(=O)[C@H]2NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](NC(=O)[C@@H](N)CSSC2)CC3=CC=C(O)C=C3
缩宫素 InChi 编码:
InChI=1S/C43H66N12O12S2.C2H4O2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59;1-2(3)4/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64);1H3,(H,3,4)/t22-,25-,26-,27-,28-,29-,30-,31-,35-;/m0./s1
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如果您想了解更多关于巯基乙酸的物化性质，请参考我们化工词典中收录的词条：缩宫素
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