Molecule FYI-1009695

A

Molecule Summary:

ID: FYI-1009695
Names:
InChIKey: DPQCZNIGGNJGTD-MVCBGFDASA-N
SMILES: CCCCCC/C=C/CCCCCCCCCC(=O)O[C@@H](C)[C@@H](C)OC(=O)CCCCCCC/C=C\\CCCCCC

Received at FYIcenter.com on: 2024-05-16

Molecule ID: FYI-1009695 Edit

Molecule Structure InChIKey: DPQCZNIGGNJGTD-MVCBGFDASA-N

Molecule Structure SMILES String: CCCCCC/C=C/CCCCCCCCCC(=O)O[C@@H](C)[C@@H](C)OC(=O)CCCCCCC/C=C\CCCCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1009695
FYIcenter.com

 42 41  0  0  1  0  0  0  0  0999 V2000
   41.2228    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   40.0104    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   38.7980    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   37.5856    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.3730    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.1606    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.9482    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.7358    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.5233    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.3109    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4248    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    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
  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  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
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 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
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 20 18  1  0  0  0  0
 21 20  1  1  0  0  0
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 24 23  1  0  0  0  0
 23 25  1  6  0  0  0
 26 25  1  0  0  0  0
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 28 26  1  0  0  0  0
 29 28  1  0  0  0  0
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 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  2  0  0  0  0
 37 36  1  0  0  0  0
 38 37  1  0  0  0  0
 39 38  1  0  0  0  0
 40 39  1  0  0  0  0
 41 40  1  0  0  0  0
 42 41  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1009695-3D
FYIcenter.com

112111  0  0  1  0  0  0  0  0999 V2000
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 23 25  1  0  0  0  0
 23 80  1  6  0  0  0
 24 81  1  0  0  0  0
 24 82  1  0  0  0  0
 24 83  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  2  0  0  0  0
 26 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 84  1  0  0  0  0
 28 85  1  0  0  0  0
 29 30  1  0  0  0  0
 29 86  1  0  0  0  0
 29 87  1  0  0  0  0
 30 31  1  0  0  0  0
 30 88  1  0  0  0  0
 30 89  1  0  0  0  0
 31 32  1  0  0  0  0
 31 90  1  0  0  0  0
 31 91  1  0  0  0  0
 32 33  1  0  0  0  0
 32 92  1  0  0  0  0
 32 93  1  0  0  0  0
 33 34  1  0  0  0  0
 33 94  1  0  0  0  0
 33 95  1  0  0  0  0
 34 35  1  0  0  0  0
 34 96  1  0  0  0  0
 34 97  1  0  0  0  0
 35 36  2  0  0  0  0
 35 98  1  0  0  0  0
 36 37  1  0  0  0  0
 36 99  1  0  0  0  0
 37 38  1  0  0  0  0
 37100  1  0  0  0  0
 37101  1  0  0  0  0
 38 39  1  0  0  0  0
 38102  1  0  0  0  0
 38103  1  0  0  0  0
 39 40  1  0  0  0  0
 39104  1  0  0  0  0
 39105  1  0  0  0  0
 40 41  1  0  0  0  0
 40106  1  0  0  0  0
 40107  1  0  0  0  0
 41 42  1  0  0  0  0
 41108  1  0  0  0  0
 41109  1  0  0  0  0
 42110  1  0  0  0  0
 42111  1  0  0  0  0
 42112  1  0  0  0  0
M  END
$$$$

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