Molecule Editor

Molecule ID: FYI-1004462 Edit

Molecule Structure InChIKey: VNJJVDXDLGZLDX-MWAVMZGNSA-N

Molecule Structure SMILES String: C=CC1=C(C)C(=O)NC1Cc5[nH]c(CC4=C(C)C3C(=O)C/C(=C/2NC(C(=O)O)C(C)C2CCC(=O)O)C3N4)c(CC)c5C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004462
FYIcenter.com

 43 47  0  0  0  0  0  0  0  0999 V2000
   12.9745    8.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5820    9.0855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7592    7.9528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3592    7.9528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9265    6.6214    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0592    5.7985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1918    6.6214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5232    6.1888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0592    4.3985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2716    3.6985    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4179    2.3062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
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  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
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  7  6  2  0  0  0  0
  7  3  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
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 41 22  1  0  0  0  0
 42 41  2  0  0  0  0
 43 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004462-3D
FYIcenter.com

 85 89  0  0  1  0  0  0  0  0999 V2000
    7.7819    8.6401    8.1156 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$