Molecule Editor

Molecule ID: FYI-1004502 Edit

Molecule Structure InChIKey: PRAKJMSDJKAYCZ-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004502
FYIcenter.com

 30 29  0  0  0  0  0  0  0  0999 V2000
   27.8860    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    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
   15.7617    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    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
    7.2746    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    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  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  7  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 12  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  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
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 23  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004502-3D
FYIcenter.com

 92 91  0  0  1  0  0  0  0  0999 V2000
    0.8639   -0.1580    0.0748 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3893   -0.1936    0.0457 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8828   -0.1714   -1.4049 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494    0.9721    0.8820 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4720    0.9801    0.8979 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0426    2.1315    1.7246 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5804    2.1165    1.7196 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.1543    2.2525    0.2983 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0958    3.2246    2.6559 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6160    3.2441    2.6860 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1801    4.3190    3.5937 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7180    4.3030    3.5762 C   0  0  3  0  0  0  0  0  0  0  0  0
   11.2988    4.5262    2.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2034    5.3627    4.5686 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7159    5.3940    4.6796 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1458    6.3953    5.7372 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6608    6.4239    5.7811 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2259    7.5012    6.7152 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.8239    7.2413    8.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7584    7.5627    6.5847 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1782    8.0026    5.1799 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6893    8.0510    5.0171 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0990    8.3279    3.5549 C   0  0  3  0  0  0  0  0  0  0  0  0
   18.5973    9.6954    3.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6277    8.2359    3.3824 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.1404    6.8093    3.6251 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6508    6.6967    3.4521 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1616    5.2842    3.7921 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.5609    4.2114    2.8799 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.6859    5.2502    3.7099 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4465   -1.0053   -0.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4818    0.7645   -0.3754 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4941   -0.2139    1.1037 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7184   -1.1367    0.5005 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6887    0.7985   -1.8756 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3855   -0.9453   -1.9987 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9572   -0.3713   -1.4667 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5778    0.8947    1.9114 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5848    1.9277    0.4833 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8211    1.0811   -0.1305 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8479    0.0269    1.2866 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6778    2.0487    2.7551 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6768    3.0886    1.3303 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9168    1.1517    2.1233 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8840    3.2173   -0.1433 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8070    1.4583   -0.3651 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2442    2.1613    0.2869 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7118    3.0617    3.6714 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7211    4.2024    2.3265 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9715    3.4461    1.6759 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9974    2.2618    2.9887 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8201    4.1559    4.6175 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8120    5.3039    3.2790 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0577    3.3184    3.9250 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9985    5.4994    1.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9830    3.7510    1.4670 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3914    4.4766    2.1711 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7782    5.1496    5.5580 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.8361    6.3521    4.2710 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.1612    5.6854    3.7217 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0969    4.3956    4.9273 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7330    6.1066    6.7090 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7605    7.3905    5.4841 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9971    6.6030    4.7543 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0497    5.4384    6.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.8155    8.4761    6.4220 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1523    6.2507    8.4999 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7390    7.2997    8.2959 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2652    7.9905    8.8342 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1921    6.5815    6.8168 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1635    8.2741    7.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7359    8.9828    4.9738 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.8020    7.3075    4.4253 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.0765    7.0785    5.3389 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1193    8.8041    5.6858 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.6379    7.5679    2.9110 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.9578   10.4983    3.7292 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.5036    9.7360    3.0604 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.9352    9.9023    2.0576 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1238    8.9388    4.0577 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8918    8.5317    2.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.6182    6.1423    2.9344 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8956    6.4827    4.6399 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.1377    7.4232    4.1160 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.9281    6.9656    2.4255 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.8764    5.0470    4.8257 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.7164    4.4573    1.8241 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.4862    4.0979    3.0488 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.0176    3.2350    3.0732 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.0343    5.4869    2.6993 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.0665    4.2596    3.9794 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.1267    5.9757    4.4018 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 31  1  0  0  0  0
  1 32  1  0  0  0  0
  1 33  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 34  1  0  0  0  0
  3 35  1  0  0  0  0
  3 36  1  0  0  0  0
  3 37  1  0  0  0  0
  4  5  1  0  0  0  0
  4 38  1  0  0  0  0
  4 39  1  0  0  0  0
  5  6  1  0  0  0  0
  5 40  1  0  0  0  0
  5 41  1  0  0  0  0
  6  7  1  0  0  0  0
  6 42  1  0  0  0  0
  6 43  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 44  1  0  0  0  0
  8 45  1  0  0  0  0
  8 46  1  0  0  0  0
  8 47  1  0  0  0  0
  9 10  1  0  0  0  0
  9 48  1  0  0  0  0
  9 49  1  0  0  0  0
 10 11  1  0  0  0  0
 10 50  1  0  0  0  0
 10 51  1  0  0  0  0
 11 12  1  0  0  0  0
 11 52  1  0  0  0  0
 11 53  1  0  0  0  0
 12 13  1  0  0  0  0
 12 14  1  0  0  0  0
 12 54  1  0  0  0  0
 13 55  1  0  0  0  0
 13 56  1  0  0  0  0
 13 57  1  0  0  0  0
 14 15  1  0  0  0  0
 14 58  1  0  0  0  0
 14 59  1  0  0  0  0
 15 16  1  0  0  0  0
 15 60  1  0  0  0  0
 15 61  1  0  0  0  0
 16 17  1  0  0  0  0
 16 62  1  0  0  0  0
 16 63  1  0  0  0  0
 17 18  1  0  0  0  0
 17 64  1  0  0  0  0
 17 65  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 66  1  0  0  0  0
 19 67  1  0  0  0  0
 19 68  1  0  0  0  0
 19 69  1  0  0  0  0
 20 21  1  0  0  0  0
 20 70  1  0  0  0  0
 20 71  1  0  0  0  0
 21 22  1  0  0  0  0
 21 72  1  0  0  0  0
 21 73  1  0  0  0  0
 22 23  1  0  0  0  0
 22 74  1  0  0  0  0
 22 75  1  0  0  0  0
 23 24  1  0  0  0  0
 23 25  1  0  0  0  0
 23 76  1  0  0  0  0
 24 77  1  0  0  0  0
 24 78  1  0  0  0  0
 24 79  1  0  0  0  0
 25 26  1  0  0  0  0
 25 80  1  0  0  0  0
 25 81  1  0  0  0  0
 26 27  1  0  0  0  0
 26 82  1  0  0  0  0
 26 83  1  0  0  0  0
 27 28  1  0  0  0  0
 27 84  1  0  0  0  0
 27 85  1  0  0  0  0
 28 29  1  0  0  0  0
 28 30  1  0  0  0  0
 28 86  1  0  0  0  0
 29 87  1  0  0  0  0
 29 88  1  0  0  0  0
 29 89  1  0  0  0  0
 30 90  1  0  0  0  0
 30 91  1  0  0  0  0
 30 92  1  0  0  0  0
M  END
$$$$