Molecule Editor

Molecule ID: FYI-1010625 Edit

Molecule Structure InChIKey: VCRBIAYGPJRCLX-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C(O)CCCCC(=O)OCCCCOC(=O)c2ccc(C(=O)OCCCCOC(=O)c1ccc(C(=O)OCCCCOC(=O)CCCCC(=O)OCCCCOCCCCO)cc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1010625
FYIcenter.com

 66 67  0  0  0  0  0  0  0  0999 V2000
   48.4974    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   49.7099    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   47.2850    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   47.2850    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0725    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0725    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.8601    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   44.8601    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   42.4352   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   42.4352   14.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   40.0104   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7979   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5855   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   38.7979   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3730   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606   16.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   36.3730   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   35.1606   20.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482   22.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.7357   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482   25.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0984   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0984   25.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109   24.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   28.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735   26.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362   27.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114   27.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990   26.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000   26.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
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 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
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 17 16  2  0  0  0  0
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 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 23 18  1  0  0  0  0
 24 21  1  0  0  0  0
 25 24  2  0  0  0  0
 26 24  1  0  0  0  0
 27 26  1  0  0  0  0
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 29 28  1  0  0  0  0
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 31 30  1  0  0  0  0
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 33 32  2  0  0  0  0
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 35 34  2  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
 38 37  1  0  0  0  0
 39 38  2  0  0  0  0
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 40 37  1  0  0  0  0
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 63 62  1  0  0  0  0
 64 63  1  0  0  0  0
 65 64  1  0  0  0  0
 66 65  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010625-3D
FYIcenter.com

132133  0  0  0  0  0  0  0  0999 V2000
   -2.2624  -10.2349   12.4848 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.2071  -10.8588   10.5314 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2756   -9.3460   12.5521 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$