Molecule FYI-1016249

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Molecule Summary:

ID: FYI-1016249
Names:
InChIKey: LSENDSPQSVKKLZ-UHFFFAOYSA-N
SMILES: O=C1CCCCNC(=O)CCCCC(=O)NCCCCCCN1

Received at FYIcenter.com on: 2025-12-01

Molecule ID: FYI-1016249 Edit

Molecule Structure InChIKey: LSENDSPQSVKKLZ-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCNC(=O)CCCCC(=O)NCCCCCCN1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016249
FYIcenter.com

 23 23  0  0  0  0  0  0  0  0999 V2000
    1.1811    5.0585    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3623    5.8101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6414    5.2410    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7738    6.0641    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0012    5.3907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2121    6.0933    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.8101    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5621    5.7224    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6229    6.6360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3974    8.0177    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9385    6.1572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.2252    5.6053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6818    4.2819    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9833    2.9147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1066    1.5202    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2514    0.7142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6626    0.1925    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2759    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8808    0.1171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4840    0.2117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1593    0.6646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8738    1.2191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5862    0.6694    0.0000 O   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
  1  7  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 22  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016249-3D
FYIcenter.com

 54 54  0  0  0  0  0  0  0  0999 V2000
    6.9986    4.5129    5.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6318    3.9160    6.0079 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1565    4.1946    7.5673 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2346    5.2152    8.2756 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8216    6.5698    9.1068 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7553    7.2126    8.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8805    8.2758    8.0283 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4887    8.1417    6.6623 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3234    8.4217    6.3764 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4606    7.3141    5.6223 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0929    7.3828    5.5539 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9628    6.3036    4.8098 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4507    6.0714    5.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4211    5.0568    4.5034 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6295    5.1193    4.7684 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0391    4.0219    3.6798 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7020    3.5624    3.6000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1415    2.6517    2.4879 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6475    2.8881    2.7198 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4748    2.1194    2.1893 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2753    2.4408    3.1594 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4698    2.0016    4.6615 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6629    2.9356    5.8370 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6563    3.2318    7.7462 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2586    4.2127    8.1878 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7772    4.6257    9.0342 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0086    5.4922    7.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7283    7.2055    9.1545 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5515    6.3679   10.1395 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2235    6.3819    7.9042 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4646    7.7543    7.6957 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1203    8.4990    8.6538 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0583    7.5098    4.6220 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1387    6.2996    5.8509 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5655    7.3378    6.5235 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3386    8.3669    5.1656 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8477    6.4334    3.7338 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6023    5.3503    5.1317 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4625    5.6957    6.2478 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.9600    7.0375    5.2425 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.7901    3.3667    3.4964 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1653    4.4812    3.4466 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4451    3.1576    4.5878 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4245    1.6051    2.6396 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4564    2.9687    1.4892 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4306    3.9436    2.5043 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5706    2.7332    3.7906 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6690    1.0438    2.1368 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2332    2.4587    1.1716 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0008    3.4989    3.0847 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4291    1.8704    2.7487 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5461    1.4770    4.9284 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2698    1.2548    4.7205 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7741    3.3020    6.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 23  1  0  0  0  0
  3  4  1  0  0  0  0
  3 24  1  0  0  0  0
  3 25  1  0  0  0  0
  4  5  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  5  6  1  0  0  0  0
  5 28  1  0  0  0  0
  5 29  1  0  0  0  0
  6  7  1  0  0  0  0
  6 30  1  0  0  0  0
  6 31  1  0  0  0  0
  7  8  1  0  0  0  0
  7 32  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 33  1  0  0  0  0
 10 34  1  0  0  0  0
 11 12  1  0  0  0  0
 11 35  1  0  0  0  0
 11 36  1  0  0  0  0
 12 13  1  0  0  0  0
 12 37  1  0  0  0  0
 12 38  1  0  0  0  0
 13 14  1  0  0  0  0
 13 39  1  0  0  0  0
 13 40  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 41  1  0  0  0  0
 17 18  1  0  0  0  0
 17 42  1  0  0  0  0
 17 43  1  0  0  0  0
 18 19  1  0  0  0  0
 18 44  1  0  0  0  0
 18 45  1  0  0  0  0
 19 20  1  0  0  0  0
 19 46  1  0  0  0  0
 19 47  1  0  0  0  0
 20 21  1  0  0  0  0
 20 48  1  0  0  0  0
 20 49  1  0  0  0  0
 21 22  1  0  0  0  0
 21 50  1  0  0  0  0
 21 51  1  0  0  0  0
 22 23  1  0  0  0  0
 22 52  1  0  0  0  0
 22 53  1  0  0  0  0
 23 54  1  0  0  0  0
M  END
$$$$

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2025-12-09, 536👍, 0💬