Molecule Editor

Molecule ID: FYI-1007289 Edit

Molecule Structure InChIKey: KTEMNGNYNQXTNG-UHFFFAOYSA-N

Molecule Structure SMILES String: C1CC4C1C2CCC2C3CCC3C5CCC45

Download SDF Download SVG Structure in 2D SDF:

FYI-1007289
FYIcenter.com

 16 20  0  0  0  0  0  0  0  0999 V2000
    3.7899    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7799    2.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7799    3.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7899    4.7799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3899    4.7799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    3.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    2.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3899    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1799    2.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1799    3.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7899    6.1799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3899    6.1799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.7899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.3899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3899    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7899    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  1  1  0  0  0  0
  9 10  1  0  0  0  0
  3 10  1  0  0  0  0
  2  9  1  0  0  0  0
 11 12  1  0  0  0  0
  5 12  1  0  0  0  0
  4 11  1  0  0  0  0
 13 14  1  0  0  0  0
  7 14  1  0  0  0  0
  6 13  1  0  0  0  0
 15 16  1  0  0  0  0
  1 16  1  0  0  0  0
  8 15  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007289-3D
FYIcenter.com

 40 44  0  0  1  0  0  0  0  0999 V2000
   -3.1420    0.0954   -0.0368 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6956    1.5747   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2963    1.0325    0.3970 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.6804   -0.2238   -0.4558 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.0768   -1.3308    0.4188 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.6113   -2.7312    0.0117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1277   -3.1658   -0.0259 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1787   -1.6994   -0.4398 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.2818   -1.0859    0.4338 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.6833   -1.6415    0.0577 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1308   -0.1645   -0.0149 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6699    0.1444   -0.4512 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0617    1.2728    0.3924 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.5992    2.6653   -0.0422 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1167    3.0962   -0.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1871    1.6190   -0.4862 C   0  0  3  0  0  0  0  0  0  0  0  0
   -3.9152   -0.1486   -0.7707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4497   -0.2928    0.9420 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1938    2.2015    0.7445 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7516    2.0721   -0.9761 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1736    0.9571    1.4829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5500   -0.2287   -1.5429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0029   -1.2127    1.5043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1095   -2.7849   -0.9658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2369   -3.2385    0.7512 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1233   -3.9353   -0.7606 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2623   -3.4741    0.9527 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1769   -1.5647   -1.5269 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1529   -0.9842    1.5165 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7426   -2.1642   -0.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1764   -2.2502    0.8195 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9062    0.0601   -0.7524 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4323    0.2486    0.9558 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5450    0.1221   -1.5366 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9793    1.1841    1.4802 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1111    2.6905   -1.0124 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2095    3.1907    0.6948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1209    3.8403   -0.8814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2882    3.4366    0.8450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1777    1.4517   -1.5684 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  4  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  3  4  1  0  0  0  0
  3 16  1  0  0  0  0
  3 21  1  0  0  0  0
  4  5  1  0  0  0  0
  4 22  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  5 23  1  0  0  0  0
  6  7  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8  9  1  0  0  0  0
  8 28  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
  9 29  1  0  0  0  0
 10 11  1  0  0  0  0
 10 30  1  0  0  0  0
 10 31  1  0  0  0  0
 11 12  1  0  0  0  0
 11 32  1  0  0  0  0
 11 33  1  0  0  0  0
 12 13  1  0  0  0  0
 12 34  1  0  0  0  0
 13 14  1  0  0  0  0
 13 16  1  0  0  0  0
 13 35  1  0  0  0  0
 14 15  1  0  0  0  0
 14 36  1  0  0  0  0
 14 37  1  0  0  0  0
 15 16  1  0  0  0  0
 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
M  END
$$$$