四丁酸核糖黄素酯(752-56-7)核磁图(1HNMR)
分子式:C33H44N4O10
分子量: 656.72
InChI:InChI=1S/C33H44N4O10/c1-7-11-25(38)44-18-24(46-27(40)13-9-3)30(47-28(41)14-10-4)23(45-26(39)12-8-2)17-37-22-16-20(6)19(5)15-21(22)34-29-31(37)35-33(43)36-32(29)42/h15-16,23-24,30H,7-14,17-18H2,1-6H3,(H,36,42,43)/t23-,24+,30-/m1/s1
InChIKey: MJNIWUJSIGSWKK-FSGGQHMVSA-N
Smiles:CC1C(C)=CC2N=C3C(=NC(=O)NC3=O)N(C[C@@H](OC(=O)CCC)[C@@H](OC(=O)CCC)[C@@H](OC(=O)CCC)COC(=O)CCC)C=2C=1
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ppm Int. Assign.
173.23 403 1 *
172.94 319 2 *
172.45 131 3 *
172.32 64 4 *
159.43 305 5
154.65 236 6
150.67 73 7
148.10 52 8
136.97 214 9
136.02 131 10
134.60 287 11
132.86 119 12
131.26 71 13
116.67 122 14
70.25 116 15
69.05 48 16
68.88 169 17
61.76 119 18
44.82 87 19
35.95 460 20 #
21 #
35.83 38 22 #
35.43 295 23 #
21.39 326 24
19.46 337 25
18.40 402 26 *1
18.25 616 27 *1
28 *1
17.65 401 29 *1
13.61 1000 30 #1
31 #1
13.56 511 32 #1
13.26 474 33 #1
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : nujol mull