N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷结构式

N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷
中文名称:N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷
英文名称:N1-Methyl-N3-[(2S)-2-(t-butoxycarbonyl)amino-3-(t-butoxycarbonyl)] propylpseudouridine
CAS No.:1613530-24-7
分子式:C23H37N3O10 分子量:515.55
N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷 数据
Mol:
3.9376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4768   -2.2821    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2907   -2.8478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2004   -2.2898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5531   -1.2063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9074   -0.3066    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7133   -1.2241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3257   -0.3406    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0286   -2.2771    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0995   -2.9973    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.1116   -2.2991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9606   -9.1283    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0532   -4.4960    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  1  0  0  0  0
  6 35  2  0  0  0  0
  7  8  2  0  0  0  0
  9  7  1  0  0  0  0
 10  7  1  0  0  0  0
 11 10  1  0  0  0  0
 11 12  1  0  0  0  0
 11 14  1  1  0  0  0
 12 13  1  0  0  0  0
 13 19  1  0  0  0  0
 15 16  1  0  0  0  0
 15  9  1  0  0  0  0
 15 18  1  0  0  0  0
 17 15  1  0  0  0  0
 19 21  2  0  0  0  0
 20 19  1  0  0  0  0
 20 34  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  2  0  0  0  0
 24 23  1  0  0  0  0
 24 13  1  0  0  0  0
 25 26  1  0  0  0  0
 27 28  1  0  0  0  0
 27 33  1  0  0  0  0
 27 26  1  6  0  0  0
 28 29  1  1  0  0  0
 30 31  1  1  0  0  0
 30 28  1  0  0  0  0
 32 33  1  0  0  0  0
 32 30  1  0  0  0  0
 32 23  1  6  0  0  0
 36 24  2  0  0  0  0
 14  6  1  0     0  0
M  END                                
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N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷 Smile 编码:
O(C(N[C@H](CN1C(=O)C([C@H]2[C@@H]([C@H](O)[C@@H](CO)O2)O)=CN(C)C1=O)CC(OC(C)(C)C)=O)=O)C(C)(C)C
N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷 InChi 编码:
1S/C23H37N3O10/c1-22(2,3)35-15(28)8-12(24-20(32)36-23(4,5)6)9-26-19(31)13(10-25(7)21(26)33)18-17(30)16(29)14(11-27)34-18/h10,12,14,16-18,27,29-30H,8-9,11H2,1-7H3,(H,24,32)/t12-,14+,16+,17+,18-/m0/s1
N1-甲基-N3-[(2S)-2-(t-丁氧羰基)氨基-3-(t-丁氧羰基)]丙基假尿苷 InChiKey 编码:
FCFCXLQCRXEWGE-GWDXOCJHSA-N