Molecule Editor

Molecule ID: FYI-1004987 Edit

Molecule Structure InChIKey: HKWJHKSHEWVOSS-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OC1C(O)C(O)C(OP(=O)(O)O)C(OP(=O)(O)O)C1O)OC(=O)CCCCCCCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1004987
FYIcenter.com

 63 63  0  0  0  0  0  0  0  0999 V2000
   32.7358   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0984   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492   15.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3367   17.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   19.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   21.0000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
   10.3995   22.2124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0995   21.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   21.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   19.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498   19.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498   21.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   21.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   21.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   23.1000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.2373   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   24.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0373   23.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   18.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   17.5000    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    2.2373   17.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373   16.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0373   17.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   17.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   18.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   15.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   14.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   13.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2125    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    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  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  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  2  0  0  0  0
 18 16  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
 25 23  1  0  0  0  0
 26 23  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 32 27  1  0  0  0  0
 33 32  1  0  0  0  0
 34 31  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  2  0  0  0  0
 37 35  1  0  0  0  0
 38 35  1  0  0  0  0
 39 30  1  0  0  0  0
 40 39  1  0  0  0  0
 41 40  2  0  0  0  0
 42 40  1  0  0  0  0
 43 40  1  0  0  0  0
 44 29  1  0  0  0  0
 45 28  1  0  0  0  0
 46 20  1  0  0  0  0
 47 46  1  0  0  0  0
 48 47  2  0  0  0  0
 49 47  1  0  0  0  0
 50 49  1  0  0  0  0
 51 50  1  0  0  0  0
 52 51  1  0  0  0  0
 53 52  1  0  0  0  0
 54 53  1  0  0  0  0
 55 54  1  0  0  0  0
 56 55  1  0  0  0  0
 57 56  1  0  0  0  0
 58 57  1  0  0  0  0
 59 58  1  0  0  0  0
 60 59  1  0  0  0  0
 61 60  1  0  0  0  0
 62 61  1  0  0  0  0
 63 62  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004987-3D
FYIcenter.com

144144  0  0  1  0  0  0  0  0999 V2000
   20.7257    7.0839   23.9587 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1803    5.7399   23.5125 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4730    5.5099   22.0352 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9305    4.1628   21.5814 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2286    3.9466   20.1049 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6871    2.6004   19.6543 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.9814    2.3796   18.1796 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4339    1.0329   17.7367 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7274    0.8050   16.2619 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1825   -0.5397   15.8038 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.4665   -0.7639   14.3252 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9358   -2.1147   13.8774 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2265   -2.3320   12.3952 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6832   -3.6782   11.9378 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.9455   -3.9516   10.4574 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4237   -5.3063   10.0703 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4012   -5.8380   10.6020 O   0  0  0  0  0  0  0  0  0  0  0  0
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   18.6981   -7.2081    8.7511 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.1810   -8.2037    9.8043 C   0  0  3  0  0  0  0  0  0  0  0  0
   18.7175   -9.6578    9.5134 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.2748  -16.4688   10.8646 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$