Molecule Editor

Molecule ID: FYI-1015808 Edit

Molecule Structure InChIKey: JOWWGYTWAWPLMJ-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCC5(c1cc(O)cc(O)c1)c2cc(O)cc(O)c2c3cc(O)cc(O)c3c4cc(O)cc(O)c45

Download SDF Download SVG Structure in 2D SDF:

FYI-1015808
FYIcenter.com

 42 46  0  0  0  0  0  0  0  0999 V2000
    7.6919    6.1695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.9003    8.2623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9003    9.6575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1085   10.3551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1085   11.7502    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3168   12.4478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3168   13.8430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5250   14.5406    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4837    5.4719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7172    4.8199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6321    3.2825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    3.3397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1856    0.9231    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5653    3.1316    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8757    1.7715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2089    1.3602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5193    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    8.9440    4.6183    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5879    4.0806    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  1  1  0  0  0  0
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 41 40  1  0  0  0  0
 42 40  2  0  0  0  0
 42 35  1  0  0  0  0
 42 10  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015808-3D
FYIcenter.com

 78 82  0  0  1  0  0  0  0  0999 V2000
    3.7152   -5.1148   -4.8669 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6874   -3.6928   -5.4215 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0995    0.8598   -5.6690 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2296    1.8450   -5.1917 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6544    1.3924   -5.5486 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9581    2.2758   -5.1296 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.8920   -2.0266   -3.5668 C   0  0  0  0  0  0  0  0  0  0  0  0
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 41 78  1  0  0  0  0
M  END
$$$$