Molecule FYI-1014391

A

Molecule Summary:

ID: FYI-1014391
Names:
InChIKey: DYEQPYSFRWUNNV-APIJFGDWSA-N
SMILES: CC(C)[C@@H]2CC[C@@]1(C)CCC[C@@H](C)[C@@H]1C2

Received at FYIcenter.com on: 2025-04-12

Molecule ID: FYI-1014391 Edit

Molecule Structure InChIKey: DYEQPYSFRWUNNV-APIJFGDWSA-N

Molecule Structure SMILES String: CC(C)[C@@H]2CC[C@@]1(C)CCC[C@@H](C)[C@@H]1C2

Download SDF Download SVG Structure in 2D SDF:

FYI-1014391
FYIcenter.com

 15 16  0  0  1  0  0  0  0  0999 V2000
    2.4250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    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
    4.8498    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4250    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    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
  2  1  1  1  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
  7  2  1  0  0  0  0
  7  8  1  6  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  6  1  0  0  0  0
  9 12  1  6  0  0  0
 13 12  1  0  0  0  0
 14 12  1  0  0  0  0
  6 15  1  6  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014391-3D
FYIcenter.com

 43 44  0     1  0  0  0  0  0999 V2000
   -0.9959   -1.0630   -0.0990 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6783    0.4314    0.2225 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8113    1.3780   -0.2568 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.7215    0.8301   -0.2833 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1136   -1.9517    0.5175 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8161   -0.0823    0.2954 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.3508   -1.4369    0.5516 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5196   -1.5662    0.0562 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1520    0.9577    0.3742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4915   -0.5097    0.1370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0745   -1.3472   -1.6199 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1841    0.2909   -0.2749 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5447    2.8488    0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4636    1.7772   -0.0674 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2806   -0.5572    0.3646 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6420    0.5246    1.3198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9042    1.3133   -1.3475 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7505    0.8295   -1.3790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9109    1.8571    0.0407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0674   -3.0070    0.2765 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0770   -1.8770    1.6127 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8326    0.0786    1.3834 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2557   -1.3976    1.6451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6194   -2.4717    0.3043 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2212   -2.1960    0.6143 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6508   -1.8182   -1.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9630    1.5792   -0.0249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1208    1.1425    1.4561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3927   -0.7690    0.7053 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7420   -0.6637   -0.9184 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1429   -1.1091   -2.1403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2833   -2.4080   -1.8023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8641   -0.7766   -2.1158 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2012    0.0985   -1.3559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7055    3.2458   -0.4967 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4165    3.4673   -0.1581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3225    2.9782    1.1470 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3017    2.0780    0.9733 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5042    2.0120   -0.3197 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8460    2.4057   -0.7164 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2334   -0.5191    1.4583 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2712   -0.1974    0.0639 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2263   -1.6034    0.0493 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1  7  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 16  1  0  0  0  0
  3  9  1  0  0  0  0
  3 13  1  0  0  0  0
  3 17  1  0  0  0  0
  4  6  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5  8  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  6 22  1  0  0  0  0
  7 10  1  0  0  0  0
  7 23  1  0  0  0  0
  7 24  1  0  0  0  0
  8 25  1  0  0  0  0
  8 26  1  0  0  0  0
  9 10  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
 10 29  1  0  0  0  0
 10 30  1  0  0  0  0
 11 31  1  0  0  0  0
 11 32  1  0  0  0  0
 11 33  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 12 34  1  0  0  0  0
 13 35  1  0  0  0  0
 13 36  1  0  0  0  0
 13 37  1  0  0  0  0
 14 38  1  0  0  0  0
 14 39  1  0  0  0  0
 14 40  1  0  0  0  0
 15 41  1  0  0  0  0
 15 42  1  0  0  0  0
 15 43  1  0  0  0  0
M  END
$$$$

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2025-04-26, 1083👍, 0💬