辅酶 A S-十四烷酸酯锂盐 | 187100-75-0

Mol：

187100-75-0.mol    by:chem960.com
    ChemDraw08031019472D

    …………    

 0  0  0  0  0  0  0  0  0
    5.6440    4.8051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4775    3.7544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6419    2.1930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3719    1.2700    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.4488    2.5400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1019    0.3470    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2949    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1177    4.5392    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6835    3.9003    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4438    6.0749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0052    6.2393    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3931    7.2415    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193    8.7782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    9.5632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597   11.1332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   11.9182    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193   11.9182    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790   11.1332    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790    9.5632    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1919    8.5123    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8308    7.0771    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
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  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
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  2  0  0  0  0
 25 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  1  0  0  0  0
 29 32  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 34 36  1  0  0  0  0
 34 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  2  0  0  0  0
 38 40  1  0  0  0  0
 38 41  1  0  0  0  0
 41 42  1  0  0  0  0
 42 43  1  0  0  0  0
 43 44  1  0  0  0  0
 44 45  1  0  0  0  0
 45 46  1  0  0  0  0
 46 47  1  0  0  0  0
 46 48  1  0  0  0  0
 46 49  2  0  0  0  0
 44 50  1  0  0  0  0
 50 51  1  0  0  0  0
 50 52  1  0  0  0  0
 52 53  1  0  0  0  0
 53 43  1  0  0  0  0
 52 54  1  0  0  0  0
 54 55  1  0  0  0  0
 55 56  1  0  0  0  0
 56 57  2  0  0  0  0
 57 58  1  0  0  0  0
 57 59  1  0  0  0  0
 59 60  2  0  0  0  0
 60 61  1  0  0  0  0
 61 55  2  0  0  0  0
 56 62  1  0  0  0  0
 62 63  2  0  0  0  0
 63 54  1  0  0  0  0
M  END                                                    

辅酶 A S-十四烷酸酯锂盐 InChIKey： DUAFKXOFBZQTQE-UHFFFAOYSA-N

辅酶 A S-十四烷酸酯锂盐 Inchi： InChI=1S/C35H62N7O17P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-26(44)63-19-18-37-25(43)16-17-38-33(47)30(46)35(2,3)21-56-62(53,54)59-61(51,52)55-20-24-29(58-60(48,49)50)28(45)34(57-24)42-23-41-27-31(36)39-22-40-32(27)42/h22-24,28-30,34,45-46H,4-21H2,1-3H3,(H,37,43)(H,38,47)(H,51,52)(H,53,54)(H2,36,39,40)(H2,48,49,50)

辅酶 A S-十四烷酸酯锂盐 SMILES： CCCCCCCCCCCCCC(SCCNC(CCNC(C(C(COP(OP(OCC1OC(N2C=NC3=C(N=CN=C23)N)C(O)C1OP(=O)(O)O)(O)=O)(O)=O)(C)C)O)=O)=O)=O

如果您需要其它格式的数据，比如：Reaction File,JSDraw2 html,CDX,CDXML等格式的文件，您可以使用我们的结构式搜索工具，可以直接进行导出(详情请点击 )； 如果您想了解更多关于辅酶 A S-十四烷酸酯锂盐的物化性质，请参考我们化工词典中收录的词条：187100-75-0 如果您有更其他更特殊的定制数据需求，请直接拨打我们的客服热线：4000 025 960 。