Molecule Editor

Molecule ID: FYI-1009873 Edit

Molecule Structure InChIKey: NJVKAQGGBANCKG-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCCOC(=O)CCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1009873
FYIcenter.com

 22 21  0  0  0  0  0  0  0  0999 V2000
   24.2487    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   20.6114    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.0000    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
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    6.0621    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 O   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 C   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
  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
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 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1009873-3D
FYIcenter.com

 62 61  0  0  0  0  0  0  0  0999 V2000
    1.0243    0.0639   -0.0656 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5422    0.0520   -0.0687 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0737   -1.3716    0.0515 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5971   -1.3854    0.0466 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1172   -2.8117    0.1650 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6388   -2.8256    0.1621 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1556   -4.2515    0.2785 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6763   -4.2632    0.2774 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1930   -5.6887    0.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7136   -5.7009    0.3925 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.7468   -7.1469    0.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2717   -8.5733    0.6186 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7946   -8.6009    0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3623   -7.8119    1.7952 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$