N-乙酰胞嘧啶核苷结构式

中文名称:N-乙酰胞嘧啶核苷
英文名称:N4-Acetylcytidine
CAS No.:3768-18-1
分子式:C11H15N3O6 分子量:285.2533
N-乙酰胞嘧啶核苷 数据
Mol:

    3.5483   11.0510    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4711   12.3211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0325   12.1570    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0335    9.5578    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1230    6.2800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1230    4.7100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0440    7.0650    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 14 17  1  0  0  0  0
 17  9  1  0  0  0  0
  8 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19  5  1  0  0  0  0
  7 20  2  0  0  0  0
M  END                                
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N-乙酰胞嘧啶核苷 Smile 编码:
C(NC1C=CN(C2OC(CO)C(O)C2O)C(=O)N=1)(=O)C
N-乙酰胞嘧啶核苷 InChi 编码:
1S/C11H15N3O6/c1-5(16)12-7-2-3-14(11(19)13-7)10-9(18)8(17)6(4-15)20-10/h2-3,6,8-10,15,17-18H,4H2,1H3,(H,12,13,16,19)/t6-,8-,9-,10-/m1/s1
N-乙酰胞嘧啶核苷 InChiKey 编码:
NIDVTARKFBZMOT-PEBGCTIMSA-N