Molecule FYI-1003885

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A

Molecule Summary:

ID: FYI-1003885
Names:
InChIKey: DCAYPVUWAIABOU-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCCCCC

Received at FYIcenter.com on: 2023-08-03

Molecule ID: FYI-1003885 Edit

Molecule Structure InChIKey: DCAYPVUWAIABOU-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1003885
FYIcenter.com

 16 15  0  0  0  0  0  0  0  0999 V2000
   18.1865    0.7000    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    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
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003885-3D
FYIcenter.com

 50 49  0     0  0  0  0  0  0999 V2000
    0.6381    0.4162   -0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6469   -0.4183   -0.1396 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9120   -0.4328   -0.1013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9201    0.4303   -0.0830 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1611    0.4472   -0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2038   -0.4052   -0.0424 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4703   -0.3484   -0.0193 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4792    0.4417   -0.0118 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7567    0.4821    0.0449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7281   -0.4436    0.0157 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0270   -0.3705    0.0948 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0380    0.3498    0.0168 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3120    0.4615    0.0795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2836   -0.5314    0.1182 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5780   -0.3813    0.0553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5555    0.3030    0.1024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6521    1.0759   -0.9965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6262    1.0650    0.7645 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6625   -1.0371   -1.0452 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6388   -1.1067    0.7146 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8860   -1.1189    0.7536 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9564   -1.0467   -1.0087 H   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1169    1.0488    0.9062 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1700    1.1517   -0.8508 H   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4993   -0.9674   -0.9252 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4597   -1.0443    0.8293 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.5094    1.0917   -0.8943 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7233    1.1293    0.9298 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7953    1.1429   -0.8296 H   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0102   -0.9959    0.9958 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0334   -1.0528   -0.7642 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0279    1.0546    0.8576 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0910    0.9517   -0.8990 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3104    1.1170   -0.7994 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3334    1.1124    0.9616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2479   -1.1198    1.0423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3055   -1.2399   -0.7179 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6332   -1.0271    0.9373 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6081   -1.0149   -0.8368 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4633    0.2620    0.0471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6352    0.8794   -0.8247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5771    1.0015    0.9450 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4344   -0.3451    0.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  4  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  3  5  1  0  0  0  0
  3 21  1  0  0  0  0
  3 22  1  0  0  0  0
  4  6  1  0  0  0  0
  4 23  1  0  0  0  0
  4 24  1  0  0  0  0
  5  7  1  0  0  0  0
  5 25  1  0  0  0  0
  5 26  1  0  0  0  0
  6  8  1  0  0  0  0
  6 27  1  0  0  0  0
  6 28  1  0  0  0  0
  7  9  1  0  0  0  0
  7 29  1  0  0  0  0
  7 30  1  0  0  0  0
  8 10  1  0  0  0  0
  8 31  1  0  0  0  0
  8 32  1  0  0  0  0
  9 11  1  0  0  0  0
  9 33  1  0  0  0  0
  9 34  1  0  0  0  0
 10 12  1  0  0  0  0
 10 35  1  0  0  0  0
 10 36  1  0  0  0  0
 11 13  1  0  0  0  0
 11 37  1  0  0  0  0
 11 38  1  0  0  0  0
 12 14  1  0  0  0  0
 12 39  1  0  0  0  0
 12 40  1  0  0  0  0
 13 15  1  0  0  0  0
 13 41  1  0  0  0  0
 13 42  1  0  0  0  0
 14 16  1  0  0  0  0
 14 43  1  0  0  0  0
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 15 45  1  0  0  0  0
 15 46  1  0  0  0  0
 15 47  1  0  0  0  0
 16 48  1  0  0  0  0
 16 49  1  0  0  0  0
 16 50  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-09, 2740👍, 0💬