Molecule Editor

Molecule ID: FYI-1015876 Edit

Molecule Structure InChIKey: UAYIOBYBKXJVAO-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(=O)NCCCCCCNC(=O)CCCCC(=O)NCCCCCCNC(=O)c1ccc(C(=O)O)cc1

Download SDF Download SVG Structure in 2D SDF:

FYI-1015876
FYIcenter.com

 38 38  0  0  0  0  0  0  0  0999 V2000
    1.2091    3.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4020    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6509    4.3799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3911    5.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4435    7.1469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8048    8.4957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4572    9.7300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3037   10.5166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3680   10.7883    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4914   11.6174    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7709   12.1758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1429   12.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0965    1.0661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.8436    1.8242    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5485    3.9239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7399    8.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0456    6.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7512    5.6570    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1512    5.6635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.8568    4.4544    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1625    3.2387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2568    4.4609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
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  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  2  0  0  0  0
  9  7  1  0  0  0  0
 10  9  1  0  0  0  0
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 13 12  1  0  0  0  0
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 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 20 19  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 27  1  1  0  0  0  0
 28 19  2  0  0  0  0
 19 29  1  0  0  0  0
 17 30  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 33 34  1  0  0  0  0
 34 35  2  0  0  0  0
 30 35  1  0  0  0  0
 30 31  2  0  0  0  0
 33 36  1  0  0  0  0
 36 37  2  0  0  0  0
 36 38  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015876-3D
FYIcenter.com

 82 82  0  0  0  0  0  0  0  0999 V2000
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   17.2045   -2.3579    4.2862 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6191   -0.9593    4.0628 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.5474    4.0705    6.4024 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1153    5.5275    6.1972 C   0  0  0  0  0  0  0  0  0  0  0  0
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   17.8557    6.2267    6.1962 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8248    6.6843    8.4416 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.2682    6.6634    8.5476 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$