Molecule Editor

Molecule ID: FYI-1005816 Edit

Molecule Structure InChIKey: GHVJPXCZMBOEAQ-YYOWIMAISA-N

Molecule Structure SMILES String: C/C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)\C=C\C=C(C)/C

Download SDF Download SVG Structure in 2D SDF:

FYI-1005816
FYIcenter.com

 25 24  0  0  0  0  0  0  0  0999 V2000
   23.0363    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8239    0.0000    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
   19.3989    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    2.1000    0.0000 C   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 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    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 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   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
    7.2747    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    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  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 13  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 19 18  1  0  0  0  0
 20 18  1  0  0  0  0
 21 20  2  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 24 23  1  0  0  0  0
 25 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005816-3D
FYIcenter.com

 59 58  0  0  0  0  0  0  0  0999 V2000
    1.0428    0.1171   -0.0992 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5467    0.0960   -0.0745 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1810   -0.8226    0.9413 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2606    0.8669   -0.9257 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7114    0.8871   -0.9475 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5002    1.6174   -1.7555 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9729    1.6002   -1.7367 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7089    0.7125   -0.7578 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6673    2.3780   -2.5942 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1219    2.4412   -2.6613 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7807    3.2264   -3.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2311    3.2957   -3.6018 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9404    4.0654   -4.4555 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2966    4.9841   -5.4734 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4167    4.0386   -4.4256 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1849    4.7736   -5.2470 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6343    4.8306   -5.3087 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3309    5.6064   -6.1735 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6853    6.5276   -7.1961 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8065    5.5997   -6.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5569    6.3481   -6.9976 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0013    6.3979   -7.0565 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7156    7.1678   -7.9082 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1544    8.1104   -8.9470 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.2231    7.1495   -7.8915 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6674   -0.2020   -1.0764 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6660    1.1203    0.1231 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4376   -1.3606    1.5369 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8007   -0.2531    1.6428 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7999   -1.5779    0.4447 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7408    1.5086   -1.6344 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1619    0.2291   -0.2198 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0377    2.2765   -2.4843 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0820    0.1144   -0.0988 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3394    1.3218   -0.0995 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3396   -0.0018   -1.3001 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1336    3.0167   -3.2989 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6938    1.8206   -1.9795 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1955    3.8399   -4.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5963    6.5328   -7.2018 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9845    6.2383   -8.2100 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.9844    7.5661   -7.0134 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.2935    4.9469   -5.4467 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.0553    6.9908   -7.7072 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.5294    5.7581   -6.3512 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.0651    8.1471   -8.9862 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.4978    7.8155   -9.9443 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.4992    9.1311   -8.7514 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.6279    6.4667   -7.1398 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.6092    8.1525   -7.6772 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.6063    6.8377   -8.8699 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 26  1  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  3 29  1  0  0  0  0
  3 30  1  0  0  0  0
  3 31  1  0  0  0  0
  4  5  1  0  0  0  0
  4 32  1  0  0  0  0
  5  6  2  0  0  0  0
  5 33  1  0  0  0  0
  6  7  1  0  0  0  0
  6 34  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  8 35  1  0  0  0  0
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  8 37  1  0  0  0  0
  9 10  1  0  0  0  0
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M  END
$$$$