PhotoClick GM1 (synthetic) 数据
Mol：
0 0 0 0 0
-2.7991 -1.4795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0847 -2.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5136 -1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3702 -3.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7991 -3.1295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2280 -1.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5136 -2.7181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6558 -2.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9425 -1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0642 -3.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6590 -1.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0642 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3734 -1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6496 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0879 -1.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3640 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8023 -1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0785 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5168 -1.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7929 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2312 -1.8931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5074 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.9457 -1.4795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2218 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.9457 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.7769 -1.4795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-10.3613 -0.7671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.9363 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2312 -2.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6509 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5168 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3654 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6918 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0798 -3.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8668 -2.3045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7943 -4.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7991 -2.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9167 0.1696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0596 -1.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9203 -1.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5313 2.4900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0013 -5.0928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
3 1 1 1
2 4 1 6
2 5 1 0
2 6 1 0
3 7 1 0
3 8 1 0
4 9 1 0
4 10 2 0
5 11 1 0
6 12 1 0
7 13 1 1
7 14 1 0
8 15 1 6
8 16 1 0
11 17 1 0
11 18 1 0
11111 1 6
12 18 1 0
12 19 1 1
13 20 1 0
14 21 1 1
14 22 1 0
16 22 1 0
16 23 1 0
16108 1 6
17 24 1 0
17 25 1 1
18 26 1 6
20 27 1 0
20 28 1 0
20109 1 1
21 29 1 0
30 23 1 6
24 31 1 0
24 32 1 6
26 33 1 0
27 34 1 1
27 35 1 0
28 36 1 0
30 37 1 0
30 38 1 0
31 39 1 0
33 40 1 0
33 41 2 0
34 42 1 0
35 43 1 6
35 44 1 0
36 44 1 0
36 45 1 6
37 46 1 6
37 47 1 0
38 48 1 6
38 49 1 0
42 50 1 0
42 51 2 0
43 52 1 0
44 53 1 6
45 54 1 0
46 55 1 0
47 56 1 0
49 56 1 0
49 57 1 1
52 58 1 0
52 59 1 0
52110 1 1
56 60 1 6
58 61 1 0
59 62 1 1
59 63 1 0
60 64 1 0
61 65 1 6
61 66 1 0
63 66 1 0
63 67 1 6
64 68 1 0
65 69 1 0
66 70 1 6
68 71 1 0
68 72 1 0
68107 1 6
71 73 1 0
72 74 1 0
72 75 1 1
73 76 1 0
73 77 2 0
74 78 2 0
76 79 1 0
78 80 1 0
79 81 1 0
80 82 1 0
81 83 1 0
82 84 1 0
83 85 1 0
84 86 1 0
85 87 1 0
86 88 1 0
87 89 1 0
88 90 1 0
89 91 1 0
90 92 1 0
91 93 1 0
92 94 1 0
93 95 1 0
93 96 1 0
93 97 1 0
94 98 1 0
95 99 1 0
96 97 2 0
98100 1 0
99101 1 0
100102 1 0
101103 1 0
102104 1 0
103105 3 0
104106 1 0
M END
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PhotoClick GM1 (synthetic) Smile 编码:
O([C@@H]1[C@H]([C@]([H])(O[C@@H]2[C@@H]([C@@H](O)[C@H](OC[C@@]([H])([C@H](O)/C=C/CCCCCCCCCCCCC)NC(=O)CCCCCCCCC3(N=N3)CCCC#C)O[C@@H]2CO)O)O[C@H](CO)[C@@H]1O[C@]1([H])O[C@H](CO)[C@H](O)[C@H](O[C@@]2([H])[C@@H]([C@@H](O)[C@@H](O)[C@@H](CO)O2)O)[C@H]1NC(=O)C)O)[C@@]1(C[C@H](O)[C@@H](NC(=O)C)[C@]([H])([C@H](O)[C@H](O)CO)O1)C(=O)O.N
PhotoClick GM1 (synthetic) InChi 编码:
1S/C70H119N5O31.H3N/c1-5-7-9-10-11-12-13-14-15-16-17-20-23-27-41(83)40(73-48(86)28-24-21-18-19-22-26-30-69(74-75-69)29-25-8-6-2)37-97-65-57(93)55(91)59(46(35-79)100-65)102-67-58(94)63(106-70(68(95)96)31-42(84)49(71-38(3)81)62(105-70)51(87)43(85)32-76)60(47(36-80)101-67)103-64-50(72-39(4)82)61(53(89)45(34-78)98-64)104-66-56(92)54(90)52(88)44(33-77)99-66;/h2,23,27,40-47,49-67,76-80,83-85,87-94H,5,7-22,24-26,28-37H2,1,3-4H3,(H,71,81)(H,72,82)(H,73,86)(H,95,96);1H3/b27-23+;/t40-,41+,42-,43+,44+,45+,46+,47+,49+,50+,51+,52-,53-,54-,55+,56+,57+,58+,59-,60-,61+,62+,63+,64-,65+,66-,67-,70-;/m0./s1
PhotoClick GM1 (synthetic) InChiKey 编码:
YAGFLORAPASTOP-KYYWCHMMSA-N
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如果您想了解更多关于PhotoClick GM1 (synthetic)的物化性质，请参考我们化工词典中收录的词条：PhotoClick GM1 (synthetic)
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