Molecule Editor

Molecule ID: FYI-1015902 Edit

Molecule Structure InChIKey: IWYJNIGOOCKQER-UHFFFAOYSA-N

Molecule Structure SMILES String: CCOC(=O)CCCCC(=O)OCCOC(=O)CCCCC(=O)OCCCCOC(=O)c1ccc(C(=O)OC)cc1

Download SDF Download SVG Structure in 2D SDF:

FYI-1015902
FYIcenter.com

 41 41  0  0  0  0  0  0  0  0999 V2000
    3.6378    3.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6380    2.0999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8505    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8506    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0628    2.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2753    1.4002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4876    2.1004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4875    3.5004    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2751    4.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0627    3.5001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6998    4.2005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9123    3.5006    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9125    2.1006    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6375   11.8993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8500   12.5991    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0624   11.8990    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2749   12.5989    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4872   11.8988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2751   13.9989    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4253    4.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   10.4988    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    9.7986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   10.4985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    9.7984    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1241    8.3984    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   10.4983    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8418    7.1963    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1596    5.9738    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2766    3.3995    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  2  0  0  0  0
  3  5  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  5 10  1  0  0  0  0
  5  6  2  0  0  0  0
  8 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
 12 14  1  0  0  0  0
  1 15  1  0  0  0  0
 16 19  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 17 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 16 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 25  1  0  0  0  0
 21 26  1  0  0  0  0
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  2  0  0  0  0
 25 32  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 30 33  1  0  0  0  0
 35 36  1  0  0  0  0
 36 37  1  0  0  0  0
 36 38  2  0  0  0  0
 37 39  1  0  0  0  0
 39 40  1  0  0  0  0
 32 41  1  0  0  0  0
 15 41  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015902-3D
FYIcenter.com

 81 81  0  0  0  0  0  0  0  0999 V2000
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   17.5292   -5.1877    5.2493 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2457   -4.2410    5.5316 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.1580   -3.8991    3.5716 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2449   -4.0333    2.3494 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9076   -4.7188    2.6367 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.5820   -4.2033    5.4596 C   0  0  0  0  0  0  0  0  0  0  0  0
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   18.0991   -6.6910   10.2763 C   0  0  0  0  0  0  0  0  0  0  0  0
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 41 81  1  0  0  0  0
M  END
$$$$