Molecule FYI-1008108

A

Molecule Summary:

ID: FYI-1008108
Names:
InChIKey: TXDHYFIGNLVLSL-FPBFKFRZSA-N
SMILES: COc4cc(/C=C/C(C/C(/C=C/c1ccc(O)c(OC)c1)=N\\C(=O)c2ccccn2)=N\\C(=O)c3cccnc3)ccc4O

Received at FYIcenter.com on: 2024-04-16

Molecule ID: FYI-1008108 Edit

Molecule Structure InChIKey: TXDHYFIGNLVLSL-FPBFKFRZSA-N

Molecule Structure SMILES String: COc4cc(/C=C/C(C/C(/C=C/c1ccc(O)c(OC)c1)=N\C(=O)c2ccccn2)=N\C(=O)c3cccnc3)ccc4O

Download SDF Download SVG Structure in 2D SDF:

FYI-1008108
FYIcenter.com

 43 46  0  0  0  0  0  0  0  0999 V2000
   13.3367    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9118    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    9.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   10.4999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   11.1999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870   10.4999    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    9.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9118    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   13.3367    9.0999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9118    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9118    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4870    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
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 40 39  1  0  0  0  0
 41 40  2  0  0  0  0
 42 41  1  0  0  0  0
 43 42  2  0  0  0  0
 43 38  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008108-3D
FYIcenter.com

 71 74  0  0  0  0  0  0  0  0999 V2000
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 43 71  1  0  0  0  0
M  END
$$$$

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2024-07-15, 1020👍, 0💬