Molecule FYI-1015354

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Molecule Summary:

ID: FYI-1015354
Names:
InChIKey: OBLCBZCULBIEMS-UHFFFAOYSA-N
SMILES: c2ccc(CCCCCCC1CCC1)cc2

Received at FYIcenter.com on: 2025-08-12

Molecule ID: FYI-1015354 Edit

Molecule Structure InChIKey: OBLCBZCULBIEMS-UHFFFAOYSA-N

Molecule Structure SMILES String: c2ccc(CCCCCCC1CCC1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1015354
FYIcenter.com

 16 17  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8496    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9118    2.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2641    2.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6263    3.7902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2740    4.1524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    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
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
  8 11  1  0  0  0  0
  8  9  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
  1 16  1  0  0  0  0
  1 12  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015354-3D
FYIcenter.com

 40 41  0  0  0  0  0  0  0  0999 V2000
    1.2930   -2.3479   -1.0440 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3766   -3.2735   -0.5510 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9913   -3.0369   -0.6802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4503   -1.8747   -1.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9266   -1.6408   -1.4804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5429   -0.9044   -0.2894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0338   -0.6254   -0.4935 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8686   -1.9029   -0.6438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3587   -1.6363   -0.8467 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6493   -0.8800   -2.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1446   -0.6573   -2.2959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5741    0.1773   -3.5300 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6499    0.8202   -2.6316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7527    0.4756   -1.4268 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5237   -0.9403   -1.7886 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8432   -1.1795   -1.6565 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3587   -2.5377   -0.9511 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7258   -4.1844   -0.0714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6973   -3.7697   -0.2962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4044   -2.6163   -1.6252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1063   -1.0788   -2.4055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0301    0.0558   -0.1450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3972   -1.4765    0.6346 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1403    0.0102   -1.3784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4090   -0.0476    0.3595 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7383   -2.5213    0.2518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5155   -2.4964   -1.4917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7579   -1.0897    0.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8789   -2.6009   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2701   -1.4551   -2.9980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1332    0.0857   -2.1547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7121   -1.5961   -2.2265 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9492   -0.3978   -4.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8172    0.8862   -3.8871 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6057    0.2851   -2.6360 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8320    1.8837   -2.7980 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2722    0.1512   -0.5220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0486    1.2747   -1.1643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8624   -0.0282   -2.2754 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5596   -0.4573   -2.0406 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  2  0  0  0  0
  1 17  1  0  0  0  0
  2  3  2  0  0  0  0
  2 18  1  0  0  0  0
  3  4  1  0  0  0  0
  3 19  1  0  0  0  0
  4  5  1  0  0  0  0
  4 15  2  0  0  0  0
  5  6  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6  7  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  7  8  1  0  0  0  0
  7 24  1  0  0  0  0
  7 25  1  0  0  0  0
  8  9  1  0  0  0  0
  8 26  1  0  0  0  0
  8 27  1  0  0  0  0
  9 10  1  0  0  0  0
  9 28  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 14  1  0  0  0  0
 11 32  1  0  0  0  0
 12 13  1  0  0  0  0
 12 33  1  0  0  0  0
 12 34  1  0  0  0  0
 13 14  1  0  0  0  0
 13 35  1  0  0  0  0
 13 36  1  0  0  0  0
 14 37  1  0  0  0  0
 14 38  1  0  0  0  0
 15 16  1  0  0  0  0
 15 39  1  0  0  0  0
 16 40  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2025-08-18, 1126👍, 0💬