Molecule FYI-1003543

A

Molecule Summary:

ID: FYI-1003543
Names:
InChIKey: GFLZVIUGJVSYJX-LZYCVMHZSA-N
SMILES: C=C2CCC1C(C)(C)CCC[C@]1(C)[C@H]2C/C=C\\3CCOC3=O

Received at FYIcenter.com on: 2023-06-29

Molecule ID: FYI-1003543 Edit

Molecule Structure InChIKey: GFLZVIUGJVSYJX-LZYCVMHZSA-N

Molecule Structure SMILES String: C=C2CCC1C(C)(C)CCC[C@]1(C)[C@H]2C/C=C\3CCOC3=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1003543
FYIcenter.com

 22 24  0  0  1  0  0  0  0  0999 V2000
    8.4655    6.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8531    7.2292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6407    3.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0656    5.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2780    4.4292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1098    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0656    0.9291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 21 20  2  0  0  0  0
 22 12  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003543-3D
FYIcenter.com

 52 54  0  0  1  0  0  0  0  0999 V2000
    1.0614   -0.2342   -0.1215 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1532    0.0043    0.6274 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8314   -1.1727    1.2842 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3236   -1.2244    0.9778 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0331    0.0805    1.3742 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.6065   -0.0122    1.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2064   -1.0537    2.2586 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0977   -0.4821   -0.1246 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2253    1.3444    1.7047 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5728    2.6005    1.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0508    2.5978    1.2959 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3743    1.3485    0.6649 C   0  0  1  0  0  0  0  0  0  0  0  0
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    2.7867    1.3775    0.9269 C   0  0  1  0  0  0  0  0  0  0  0  0
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 21 22  2  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-07-11, 1010👍, 0💬