Molecule FYI-1015024

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A

Molecule Summary:

ID: FYI-1015024
Names:
InChIKey: NPNUFJAVOOONJE-WDZFZDKYSA-N
SMILES: C=C1CC/C=C(C)\\CCC2C1CC2(C)C

Received at FYIcenter.com on: 2025-06-15

Molecule ID: FYI-1015024 Edit

Molecule Structure InChIKey: NPNUFJAVOOONJE-WDZFZDKYSA-N

Molecule Structure SMILES String: C=C1CC/C=C(C)\CCC2C1CC2(C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1015024
FYIcenter.com

 15 16  0  0  0  0  0  0  0  0999 V2000
    6.3792    6.4802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1668    5.7802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0943    6.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6943    6.6802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6219    5.7802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3787    4.4015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.1584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0787    3.1890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5999    1.8735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9155    1.3947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3943    2.7102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7099    3.1890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4099    4.4015    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7934    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0623    0.5916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  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  2  0  0  0  0
  8  6  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
 11  8  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 13  2  1  0  0  0  0
 14 10  1  0  0  0  0
 15 10  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015024-3D
FYIcenter.com

 39 40  0     1  0  0  0  0  0999 V2000
    2.3780   -0.4674    0.1539 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0433   -0.2835   -0.6196 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.6270    0.7222    0.5010 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1376    0.9078    0.8033 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2592   -1.5816   -0.8086 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3477   -1.6135    1.1463 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6787   -0.5153   -0.6310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1553    1.9200    0.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1938   -1.3245   -1.2283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5475    2.1048    0.6149 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1493   -1.2509   -0.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5915    1.2707   -0.1355 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3590    2.8056   -0.8102 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7261   -0.1238    0.4036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4669   -2.5705    0.6056 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1975    0.1992   -1.5965 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1263    0.2268    1.3453 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6370    1.7385    0.2924 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3864    0.9843    1.8675 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2598   -2.2202    0.0755 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -2.1587   -1.6031 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4665   -1.6032    1.7970 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3996   -2.5875    0.6465 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2153   -1.5615    1.8161 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7637   -1.4529   -1.1911 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7373    0.3030   -1.3573 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5483   -0.4345    0.0303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5248   -2.1546   -1.8667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2518   -0.4346   -1.8626 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5575    1.8868    1.6902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8319    3.1622    0.5278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4033    1.2757   -1.2145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5708    1.7524   -0.0137 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3460    2.6951   -1.2440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2142    3.6703   -1.1298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3870   -0.2014    1.2664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2368   -2.4733    1.3788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5788   -2.9952    1.0821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8404   -3.2849   -0.1357 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  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  3  1  0  0  0  0
  2  5  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  1  0  0  0  0
  3 17  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5  9  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  6 24  1  0  0  0  0
  7 25  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8 10  1  0  0  0  0
  8 13  2  0  0  0  0
  9 11  1  0  0  0  0
  9 28  1  0  0  0  0
  9 29  1  0  0  0  0
 10 12  1  0  0  0  0
 10 30  1  0  0  0  0
 10 31  1  0  0  0  0
 11 14  2  0  0  0  0
 11 15  1  0  0  0  0
 12 14  1  0  0  0  0
 12 32  1  0  0  0  0
 12 33  1  0  0  0  0
 13 34  1  0  0  0  0
 13 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 37  1  0  0  0  0
 15 38  1  0  0  0  0
 15 39  1  0  0  0  0
M  END
$$$$

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2025-06-18, 954👍, 0💬