Molecule FYI-1007591

A

Molecule Summary:

ID: FYI-1007591
Names:
InChIKey: NENGEDRGOSOOOW-UHFFFAOYSA-N
SMILES: CCCCOC(=O)C1CC(C(=O)OCCCC)CC(C(=O)OCCCC)C1

Received at FYIcenter.com on: 2024-03-05

Molecule ID: FYI-1007591 Edit

Molecule Structure InChIKey: NENGEDRGOSOOOW-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCOC(=O)C1CC(C(=O)OCCCC)CC(C(=O)OCCCC)C1

Download SDF Download SVG Structure in 2D SDF:

FYI-1007591
FYIcenter.com

 27 27  0  0  0  0  0  0  0  0999 V2000
    7.2747    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.9119    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   13.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 27 19  1  0  0  0  0
 27  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007591-3D
FYIcenter.com

 63 63  0     0  0  0  0  0  0999 V2000
    1.8398    1.2732   -1.2607 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2107   -1.5199    1.3734 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2024-03-17, 172👍, 0💬