Molecule Editor

Molecule ID: FYI-1003824 Edit

Molecule Structure InChIKey: FMMOOAYVCKXGMF-MVKOLZDDSA-N

Molecule Structure SMILES String: CCCCC/C=C/C/C=C/CCCCCCCC(=O)OCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1003824
FYIcenter.com

 22 21  0  0  0  0  0  0  0  0999 V2000
   24.2487    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.6114    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003824-3D
FYIcenter.com

 58 57  0  0  0  0  0  0  0  0999 V2000
    9.3756   -9.0901    2.3759 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8976   -8.3045    1.1657 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3608   -6.8504    1.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8805   -6.0550    0.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3463   -4.6008    0.0987 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8747   -3.8141   -1.0884 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7008   -3.2048   -1.9553 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2332   -2.4144   -3.1426 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5367   -2.3329   -5.2838 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0537   -2.9222   -6.5619 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5798   -2.9384   -6.5740 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.6308   -3.5586   -7.8880 C   0  0  0  0  0  0  0  0  0  0  0  0
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   21.4787   -2.9392  -12.8835 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.9877   -2.5917  -11.9754 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  2  3  1  0  0  0  0
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  2 27  1  0  0  0  0
  3  4  1  0  0  0  0
  3 28  1  0  0  0  0
  3 29  1  0  0  0  0
  4  5  1  0  0  0  0
  4 30  1  0  0  0  0
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  5  6  1  0  0  0  0
  5 32  1  0  0  0  0
  5 33  1  0  0  0  0
  6  7  2  0  0  0  0
  6 34  1  0  0  0  0
  7  8  1  0  0  0  0
  7 35  1  0  0  0  0
  8  9  1  0  0  0  0
  8 36  1  0  0  0  0
  8 37  1  0  0  0  0
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 10 11  1  0  0  0  0
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M  END
$$$$