Molecule Editor

Molecule ID: FYI-1016703 Edit

Molecule Structure InChIKey: HPGHRGIPHODCEW-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCC1OC1CC2OC2CCCCCCCC(=O)OCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1016703
FYIcenter.com

 24 25  0  0  0  0  0  0  0  0999 V2000
   18.3741   10.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3741    9.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    8.7249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    7.3249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9493    6.6249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9493    5.2249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2493    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6493    4.0124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.0368    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.0368    1.9124    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
   14.7368    0.7000    0.0000 O   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
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    4.8498    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
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  9  7  1  0  0  0  0
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 11 10  1  0  0  0  0
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 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 22 20  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016703-3D
FYIcenter.com

 60 61  0  0  1  0  0  0  0  0999 V2000
    6.2145   -4.8325  -10.4100 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9628   -4.7863   -8.9087 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5588   -3.3804   -8.4692 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2990   -3.2741   -6.9626 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8752   -1.8455   -6.6116 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6182   -1.6430   -5.1475 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.3034   -0.2673   -4.8624 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4504   -0.7936   -4.1881 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.7676   -0.1799   -4.5536 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8078    1.3069   -4.3613 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.0779    1.8668   -4.7398 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6824    2.0812   -3.3805 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.6118    1.4834   -2.3690 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0028    2.1203   -2.4572 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9548    1.5948   -1.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3415    2.2191   -1.5430 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$