Molecule Editor

Molecule ID: FYI-1004970 Edit

Molecule Structure InChIKey: INAAIJLSXJJHOZ-UHFFFAOYSA-O

Molecule Structure SMILES String: C[NH+]6CCN(c5ccc4nc(c3ccc2nc(c1ccc(O)cc1)[nH]c2c3)[nH]c4c5)CC6

Download SDF Download SVG Structure in 2D SDF:

FYI-1004970
FYIcenter.com

 32 37  0  0  0  0  0  0  0  0999 V2000
    0.8294   15.1056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0725   13.7268    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0000   12.8270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2431   11.4482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5587   10.9694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6312   11.8693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.0119    1.5535    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    8.7867    3.6821    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   13.1193    0.8998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8762    2.2786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5606    2.7574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4349    0.4210    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  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
  8  5  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
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 13  8  1  0  0  0  0
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 24 23  2  0  0  0  0
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 30 29  1  0  0  0  0
 31 30  2  0  0  0  0
 31 26  1  0  0  0  0
 32 29  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004970-3D
FYIcenter.com

 57 62  0     0  0  0  0  0  0999 V2000
   -9.7471    2.5628    0.0766 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5526    2.7352    0.0352 N   0  3  0  0  0  0  0  0  0  0  0  0
    6.5100    0.1479   -0.4487 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5946   -0.4240   -0.4112 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6725   -2.4363    0.5291 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7045   -1.4618   -0.1159 N   0  0  0  0  0  0  0  0  0  0  0  0
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    7.4216    1.7328    1.1643 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3277   -0.5355   -0.1850 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3562   -1.8151    0.4119 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9270   -0.6898   -0.2252 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$