Molecule Editor

Molecule ID: FYI-1002826 Edit

Molecule Structure InChIKey: ODZHYIZZTFNHHM-YIFZCUJASA-N

Molecule Structure SMILES String: C/C(/C=C/C=C(C)/C(=O)O)=C\C=C\C(C)=C/2\C(=[O+2]/1CCCCC1)CC4C2(C)CCC3C(C)(C)C(=O)CCC34C

Download SDF Download SVG Structure in 2D SDF:

FYI-1002826
FYIcenter.com

 39 42  0  0  0  0  0  0  0  0999 V2000
    7.2746    2.5777    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    3.9776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.6776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.9776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    4.6776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.9776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.6776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6158    4.1082    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9068    2.7388    0.0000 O   0  2  0  0  0  0  0  0  0  0  0  0
   15.5526    5.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8526    6.3611    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    4.6776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.0776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.9776    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8664    1.8021    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   16.2383    2.3062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
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 20 19  2  0  0  0  0
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  9 39  1  0  0  0  0
  9 35  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002826-3D
FYIcenter.com

 89 92  0  0  1  0  0  0  0  0999 V2000
    6.1046    3.4869    1.9615 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.9735    1.9419    0.2099 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8928    1.4150   -0.7691 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1815    1.7920   -0.9156 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$