Molecule Editor

Molecule ID: FYI-1016061 Edit

Molecule Structure InChIKey: XBQYAIIEDCWZOU-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(O)C(=O)OCC(=O)OC(C)C(=O)OCC(=O)OC(C)C(=O)OCC(=O)OC(C)C(=O)OC(C)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1016061
FYIcenter.com

 38 37  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.4654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2378    3.5975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3425    1.3992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2963    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5561    2.0972    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6325    1.2020    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8274    1.9315    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8835    3.3304    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0840    1.3143    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2276    2.1219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4684    1.4737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   22.9895    4.0424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1586    1.9240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.1561    0.5240    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.3689    2.6277    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6758    2.1257    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9824    2.6284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.1121    4.0224    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.1538    1.8616    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1558    3.6279    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.8449    0.7359    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
  2  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
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 11 12  1  0  0  0  0
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 12 14  1  0  0  0  0
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 15 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  2  0  0  0  0
 19 21  1  0  0  0  0
 11 22  1  0  0  0  0
 18 23  1  0  0  0  0
 21 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
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
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 32 33  1  0  0  0  0
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 34 35  2  0  0  0  0
 34 36  1  0  0  0  0
 16 37  2  0  0  0  0
 33 38  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016061-3D
FYIcenter.com

 66 65  0  0  1  0  0  0  0  0999 V2000
   16.3215   -1.2247  -13.7043 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3114   -2.3551  -13.6198 C   0  0  3  0  0  0  0  0  0  0  0  0
   15.5342   -3.4144  -12.6890 O   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3250   -3.4543  -13.6055 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0366   -3.6213  -13.0724 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0318   -3.7149  -11.5789 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0114   -3.6390  -10.8207 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7386   -3.8525  -11.1855 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4228   -3.7230   -9.7916 C   0  0  3  0  0  0  0  0  0  0  0  0
   10.9544   -4.9201   -9.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7999   -2.3450   -9.2517 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0120   -1.3626   -9.9518 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.7715   -2.3281   -7.8923 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1533   -1.0784   -7.3205 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6678   -0.8638   -7.2050 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1777   -0.2412   -6.2807 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3617   -1.4419   -8.2264 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.8098   -1.4040   -8.1712 C   0  0  3  0  0  0  0  0  0  0  0  0
   15.2570   -2.6218   -7.3707 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4669   -1.4374   -9.5845 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8727   -1.2293  -10.6353 O   0  0  0  0  0  0  0  0  0  0  0  0
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  1  2  1  0  0  0  0
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M  END
$$$$