Molecule Editor

Molecule ID: FYI-1004215 Edit

Molecule Structure InChIKey: KUPLEGDPSCCPJI-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1004215
FYIcenter.com

 40 39  0  0  0  0  0  0  0  0999 V2000
   47.2850    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   46.0726    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   44.8601    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   43.6477    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   42.4353    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.2229    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0103    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7979    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5855    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3731    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7358    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5234    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3108    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0984    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.8860    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6736    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    0.7000    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
   20.6114    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
   12.1244    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    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 C   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
    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
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  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 19  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 24  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 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  1  0  0  0  0
 38 37  1  0  0  0  0
 39 38  1  0  0  0  0
 40 39  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004215-3D
FYIcenter.com

122121  0  0  0  0  0  0  0  0999 V2000
    0.9536    0.1227    0.0305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4705    0.1195    0.0341 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0008   -0.6072    1.2632 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5227   -0.6155    1.2695 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0382   -1.3435    2.5009 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5572   -1.3521    2.5073 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0689   -2.0779    3.7386 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5868   -2.0863    3.7413 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0980   -2.8115    4.9719 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6150   -2.8178    4.9739 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1256   -3.5417    6.2049 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6422   -3.5456    6.2077 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1518   -4.2703    7.4393 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6688   -4.2738    7.4420 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1790   -4.9983    8.6737 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6969   -5.0000    8.6766 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2061   -5.7260    9.9100 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7228   -5.7287    9.9137 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2329   -6.4538   11.1442 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7495   -6.4560   11.1485 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.2598   -7.1814   12.3786 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.7764   -7.1824   12.3841 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.2860   -7.9088   13.6142 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.8027   -7.9080   13.6198 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.3130   -8.6334   14.8502 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.8292   -8.6332   14.8556 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.3399   -9.3610   16.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
   28.8569   -9.3597   16.0909 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.3682  -10.0887   17.3186 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.8845  -10.0877   17.3254 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.3945  -10.8162   18.5545 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.9111  -10.8145   18.5599 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.4222  -11.5441   19.7899 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.9400  -11.5439   19.7974 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.4518  -12.2748   21.0259 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.9706  -12.2763   21.0364 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.4861  -13.0079   22.2658 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.0077  -13.0075   22.2769 C   0  0  0  0  0  0  0  0  0  0  0  0
   39.5377  -13.7391   23.5029 C   0  0  0  0  0  0  0  0  0  0  0  0
   41.0548  -13.7346   23.5091 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5742    0.6409   -0.8541 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5652    0.6291    0.9206 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5633   -0.8994    0.0194 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8414    1.1508    0.0226 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8392   -0.3694   -0.8752 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6279   -1.6387    1.2769 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6324   -0.1186    2.1736 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9028    0.4133    1.2614 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8982   -1.1079    0.3641 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6612   -2.3736    2.5117 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6659   -0.8529    3.4087 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9371   -0.3231    2.4974 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9321   -1.8454    1.6021 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6906   -3.1076    3.7512 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6975   -1.5849    4.6456 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9665   -1.0571    3.7297 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9597   -2.5799    2.8354 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7200   -3.8413    4.9833 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7253   -2.3189    5.8784 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9934   -1.7883    4.9616 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9884   -3.3113    4.0679 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7486   -4.5719    6.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7515   -3.0482    7.1113 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0189   -2.5152    6.1986 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0175   -4.0376    5.3020 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7763   -5.3012    7.4497 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7767   -3.7791    8.3460 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0444   -3.2429    7.4343 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0410   -4.7646    6.5340 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.8038   -6.0282    8.6844 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.8032   -4.5074    9.5806 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0721   -3.9705    8.6690 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.0711   -5.4913    7.7726 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.8303   -6.7568    9.9190 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.8302   -5.2353   10.8157 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.0984   -4.6979    9.9041 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.0986   -6.2201    9.0075 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.8572   -7.4843   11.1535 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.8569   -5.9629   12.0503 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1251   -5.4253   11.1391 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1253   -6.9466   10.2421 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8851   -8.2123   12.3875 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.8827   -6.6916   13.2850 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.1507   -6.1514   12.3763 H   0  0  0  0  0  0  0  0  0  0  0  0
   23.1534   -7.6714   11.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.9123   -8.9403   13.6206 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.9081   -7.4205   14.5209 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.1763   -6.8766   13.6118 H   0  0  0  0  0  0  0  0  0  0  0  0
   25.1804   -8.3970   12.7132 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.9383   -9.6645   14.8586 H   0  0  0  0  0  0  0  0  0  0  0  0
   24.9357   -8.1435   15.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.2039   -7.6027   14.8481 H   0  0  0  0  0  0  0  0  0  0  0  0
   27.2067   -9.1225   13.9485 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.9665  -10.3927   16.0904 H   0  0  0  0  0  0  0  0  0  0  0  0
   26.9621   -8.8733   16.9919 H   0  0  0  0  0  0  0  0  0  0  0  0
   29.2305   -8.3281   16.0858 H   0  0  0  0  0  0  0  0  0  0  0  0
   29.2348   -9.8463   15.1833 H   0  0  0  0  0  0  0  0  0  0  0  0
   28.9943  -11.1188   17.3243 H   0  0  0  0  0  0  0  0  0  0  0  0
   28.9892   -9.6029   18.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.2584   -9.0566   17.3204 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.2624  -10.5751   16.4181 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.0209  -11.8476   18.5593 H   0  0  0  0  0  0  0  0  0  0  0  0
   31.0173  -10.3285   19.4621 H   0  0  0  0  0  0  0  0  0  0  0  0
   33.2845   -9.7836   18.5559 H   0  0  0  0  0  0  0  0  0  0  0  0
   33.2891  -11.3017   17.6536 H   0  0  0  0  0  0  0  0  0  0  0  0
   33.0482  -12.5752   19.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
   33.0436  -11.0575   20.6971 H   0  0  0  0  0  0  0  0  0  0  0  0
   35.3125  -10.5121   19.7931 H   0  0  0  0  0  0  0  0  0  0  0  0
   35.3173  -12.0289   18.8887 H   0  0  0  0  0  0  0  0  0  0  0  0
   35.0767  -13.3057   21.0285 H   0  0  0  0  0  0  0  0  0  0  0  0
   35.0718  -11.7889   21.9330 H   0  0  0  0  0  0  0  0  0  0  0  0
   37.3429  -11.2444   21.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
   37.3477  -12.7608   20.1273 H   0  0  0  0  0  0  0  0  0  0  0  0
   37.1117  -14.0389   22.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
   37.1049  -12.5225   23.1725 H   0  0  0  0  0  0  0  0  0  0  0  0
   39.3750  -11.9740   22.2714 H   0  0  0  0  0  0  0  0  0  0  0  0
   39.3822  -13.4881   21.3648 H   0  0  0  0  0  0  0  0  0  0  0  0
   39.1722  -14.7724   23.5073 H   0  0  0  0  0  0  0  0  0  0  0  0
   39.1648  -13.2577   24.4144 H   0  0  0  0  0  0  0  0  0  0  0  0
   41.4481  -14.2345   22.6185 H   0  0  0  0  0  0  0  0  0  0  0  0
   41.4347  -14.2578   24.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
   41.4406  -12.7116   23.5294 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 41  1  0  0  0  0
  1 42  1  0  0  0  0
  1 43  1  0  0  0  0
  2  3  1  0  0  0  0
  2 44  1  0  0  0  0
  2 45  1  0  0  0  0
  3  4  1  0  0  0  0
  3 46  1  0  0  0  0
  3 47  1  0  0  0  0
  4  5  1  0  0  0  0
  4 48  1  0  0  0  0
  4 49  1  0  0  0  0
  5  6  1  0  0  0  0
  5 50  1  0  0  0  0
  5 51  1  0  0  0  0
  6  7  1  0  0  0  0
  6 52  1  0  0  0  0
  6 53  1  0  0  0  0
  7  8  1  0  0  0  0
  7 54  1  0  0  0  0
  7 55  1  0  0  0  0
  8  9  1  0  0  0  0
  8 56  1  0  0  0  0
  8 57  1  0  0  0  0
  9 10  1  0  0  0  0
  9 58  1  0  0  0  0
  9 59  1  0  0  0  0
 10 11  1  0  0  0  0
 10 60  1  0  0  0  0
 10 61  1  0  0  0  0
 11 12  1  0  0  0  0
 11 62  1  0  0  0  0
 11 63  1  0  0  0  0
 12 13  1  0  0  0  0
 12 64  1  0  0  0  0
 12 65  1  0  0  0  0
 13 14  1  0  0  0  0
 13 66  1  0  0  0  0
 13 67  1  0  0  0  0
 14 15  1  0  0  0  0
 14 68  1  0  0  0  0
 14 69  1  0  0  0  0
 15 16  1  0  0  0  0
 15 70  1  0  0  0  0
 15 71  1  0  0  0  0
 16 17  1  0  0  0  0
 16 72  1  0  0  0  0
 16 73  1  0  0  0  0
 17 18  1  0  0  0  0
 17 74  1  0  0  0  0
 17 75  1  0  0  0  0
 18 19  1  0  0  0  0
 18 76  1  0  0  0  0
 18 77  1  0  0  0  0
 19 20  1  0  0  0  0
 19 78  1  0  0  0  0
 19 79  1  0  0  0  0
 20 21  1  0  0  0  0
 20 80  1  0  0  0  0
 20 81  1  0  0  0  0
 21 22  1  0  0  0  0
 21 82  1  0  0  0  0
 21 83  1  0  0  0  0
 22 23  1  0  0  0  0
 22 84  1  0  0  0  0
 22 85  1  0  0  0  0
 23 24  1  0  0  0  0
 23 86  1  0  0  0  0
 23 87  1  0  0  0  0
 24 25  1  0  0  0  0
 24 88  1  0  0  0  0
 24 89  1  0  0  0  0
 25 26  1  0  0  0  0
 25 90  1  0  0  0  0
 25 91  1  0  0  0  0
 26 27  1  0  0  0  0
 26 92  1  0  0  0  0
 26 93  1  0  0  0  0
 27 28  1  0  0  0  0
 27 94  1  0  0  0  0
 27 95  1  0  0  0  0
 28 29  1  0  0  0  0
 28 96  1  0  0  0  0
 28 97  1  0  0  0  0
 29 30  1  0  0  0  0
 29 98  1  0  0  0  0
 29 99  1  0  0  0  0
 30 31  1  0  0  0  0
 30100  1  0  0  0  0
 30101  1  0  0  0  0
 31 32  1  0  0  0  0
 31102  1  0  0  0  0
 31103  1  0  0  0  0
 32 33  1  0  0  0  0
 32104  1  0  0  0  0
 32105  1  0  0  0  0
 33 34  1  0  0  0  0
 33106  1  0  0  0  0
 33107  1  0  0  0  0
 34 35  1  0  0  0  0
 34108  1  0  0  0  0
 34109  1  0  0  0  0
 35 36  1  0  0  0  0
 35110  1  0  0  0  0
 35111  1  0  0  0  0
 36 37  1  0  0  0  0
 36112  1  0  0  0  0
 36113  1  0  0  0  0
 37 38  1  0  0  0  0
 37114  1  0  0  0  0
 37115  1  0  0  0  0
 38 39  1  0  0  0  0
 38116  1  0  0  0  0
 38117  1  0  0  0  0
 39 40  1  0  0  0  0
 39118  1  0  0  0  0
 39119  1  0  0  0  0
 40120  1  0  0  0  0
 40121  1  0  0  0  0
 40122  1  0  0  0  0
M  END
$$$$