Molecule Editor

Molecule ID: FYI-1007389 Edit

Molecule Structure InChIKey: AYWLCKHHUFBVGJ-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1007389
FYIcenter.com

 28 27  0  0  0  0  0  0  0  0999 V2000
   27.8860    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6113    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    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  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  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 11  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  2  0  0  0  0
 19 17  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  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 26  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007389-3D
FYIcenter.com

 74 73  0  0  0  0  0  0  0  0999 V2000
    3.8690   -1.7775    3.0821 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6127   -2.6973    2.1120 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6787   -3.8149    1.6429 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1789   -1.8696    0.9429 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9879   -2.7056   -0.0478 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5572   -1.8506   -1.1808 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3295   -2.7319   -2.1557 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9120   -1.9500   -3.3315 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6484   -2.9164   -4.2433 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1605   -2.2891   -5.4171 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5165   -2.1668   -5.4193 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2083   -1.9157   -4.4426 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0116   -2.5514   -6.7891 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5341   -2.6075   -6.8652 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0303   -3.1986   -8.1855 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5696   -2.3954   -9.3976 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2373   -2.8511  -10.6702 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0475   -3.7561  -10.7689 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8846   -1.9875  -11.6630 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9701   -1.6171  -12.5094 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8612   -2.2242  -13.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0123   -1.6934  -14.7497 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9946   -2.2381  -16.1732 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1867   -1.6810  -16.9546 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2257   -2.2185  -18.3844 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4022   -1.6638  -19.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7628   -2.0289  -18.6102 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3154   -2.1845  -20.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8588   -3.4175    1.0351 H   0  0  0  0  0  0  0  0  0  0  0  0
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   10.6116   -3.5499   -7.0041 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9239   -3.2199   -6.0428 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9465   -1.6014   -6.7257 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.6921   -4.2371   -8.2825 H   0  0  0  0  0  0  0  0  0  0  0  0
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   15.9649   -1.9563  -14.2719 H   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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  6  7  1  0  0  0  0
  6 40  1  0  0  0  0
  6 41  1  0  0  0  0
  7  8  1  0  0  0  0
  7 42  1  0  0  0  0
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  8  9  1  0  0  0  0
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  8 45  1  0  0  0  0
  9 10  1  0  0  0  0
  9 46  1  0  0  0  0
  9 47  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
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 14 51  1  0  0  0  0
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 21 22  1  0  0  0  0
 21 58  1  0  0  0  0
 21 59  1  0  0  0  0
 22 23  1  0  0  0  0
 22 60  1  0  0  0  0
 22 61  1  0  0  0  0
 23 24  1  0  0  0  0
 23 62  1  0  0  0  0
 23 63  1  0  0  0  0
 24 25  1  0  0  0  0
 24 64  1  0  0  0  0
 24 65  1  0  0  0  0
 25 26  1  0  0  0  0
 25 66  1  0  0  0  0
 25 67  1  0  0  0  0
 26 27  1  0  0  0  0
 26 28  1  0  0  0  0
 26 68  1  0  0  0  0
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 27 70  1  0  0  0  0
 27 71  1  0  0  0  0
 28 72  1  0  0  0  0
 28 73  1  0  0  0  0
 28 74  1  0  0  0  0
M  END
$$$$