Thalidomide-Propargyne-PEG1-COOH结构式

Thalidomide-Propargyne-PEG1-COOH
英文名称:Thalidomide-Propargyne-PEG1-COOH
CAS No.:2828438-36-2
分子式:C19H16N2O7 分子量:384.339545249939
Thalidomide-Propargyne-PEG1-COOH 数据
Mol:
   0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7270   -0.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3312    0.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3312   -1.6224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4651   -0.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4651   -1.1224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5991    0.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7331    0.8776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8671    1.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1350    1.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2690    0.8776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4030    1.3776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  2  0
  2 14  2  0
  3 15  2  0
  4 18  2  0
  5 25  1  0
  5 26  1  0
  6 28  1  0
  7 28  2  0
  8 10  1  0
  8 14  1  0
  8 15  1  0
  9 13  1  0
  9 18  1  0
 10 11  1  0
 10 13  1  0
 11 12  1  0
 12 18  1  0
 14 16  1  0
 15 17  1  0
 16 17  2  0
 16 19  1  0
 17 20  1  0
 19 21  2  0
 20 22  2  0
 21 22  1  0
 21 23  1  0
 23 24  3  0
 24 25  1  0
 26 27  1  0
 27 28  1  0
M  END                                
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Thalidomide-Propargyne-PEG1-COOH Smile 编码:
O=C1C(CCC(N1)=O)N1C(C2C=CC(C#CCOCCC(=O)O)=CC=2C1=O)=O
Thalidomide-Propargyne-PEG1-COOH InChi 编码:
1S/C19H16N2O7/c22-15-6-5-14(17(25)20-15)21-18(26)12-4-3-11(10-13(12)19(21)27)2-1-8-28-9-7-16(23)24/h3-4,10,14H,5-9H2,(H,23,24)(H,20,22,25)
Thalidomide-Propargyne-PEG1-COOH InChiKey 编码:
HVNLXJHGBVADJO-UHFFFAOYSA-N