Molecule FYI-1003688

A

Molecule Summary:

ID: FYI-1003688
Names:
InChIKey: UKSWTFQUQNOKOF-FPLPWBNLSA-N
SMILES: CCCCCC/C=C\\CCCCCCCCCC(=O)NCCc1ccccc1

Received at FYIcenter.com on: 2023-07-18

Molecule ID: FYI-1003688 Edit

Molecule Structure InChIKey: UKSWTFQUQNOKOF-FPLPWBNLSA-N

Molecule Structure SMILES String: CCCCCC/C=C\CCCCCCCCCC(=O)NCCc1ccccc1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003688
FYIcenter.com

 28 28  0  0  0  0  0  0  0  0999 V2000
   24.2487    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0362    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   21.8238    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6114    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3989    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2747    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   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
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  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
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 13 12  1  0  0  0  0
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 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
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 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
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 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
 28 27  2  0  0  0  0
 28 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003688-3D
FYIcenter.com

 71 71  0  0  0  0  0  0  0  0999 V2000
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    7.1518   -6.7320   -4.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
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   21.6161   -0.2035   -0.5649 N   0  0  0  0  0  0  0  0  0  0  0  0
   23.0034   -0.4192   -0.9393 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9655    0.0924    0.1216 C   0  0  0  0  0  0  0  0  0  0  0  0
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 23 24  1  0  0  0  0
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 27 28  1  0  0  0  0
 27 70  1  0  0  0  0
 28 71  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-07-29, 1842👍, 0💬