Molecule FYI-1003865

A

Molecule Summary:

ID: FYI-1003865
Names:
InChIKey: YIWALJCACDQZCP-DYESRHJHSA-N
SMILES: C=C1CCC=C[C@H]1C4=C3CC=C(C2=CC(O)=CC=CC2)C=C3[C@H](C)C4

Received at FYIcenter.com on: 2023-08-01

Molecule ID: FYI-1003865 Edit

Molecule Structure InChIKey: YIWALJCACDQZCP-DYESRHJHSA-N

Molecule Structure SMILES String: C=C1CCC=C[C@H]1C4=C3CC=C(C2=CC(O)=CC=CC2)C=C3[C@H](C)C4

Download SDF Download SVG Structure in 2D SDF:

FYI-1003865
FYIcenter.com

 25 28  0  0  1  0  0  0  0  0999 V2000
   10.9575    1.5624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1699    3.6624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1699    5.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9575    5.7624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7450    5.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7450    3.6624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5326    2.9624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 22 21  2  0  0  0  0
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 23 24  1  1  0  0  0
 25 23  1  0  0  0  0
 25  8  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003865-3D
FYIcenter.com

 51 54  0  0  1  0  0  0  0  0999 V2000
    5.4295   -1.4861    0.6185 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1977   -1.5675    0.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0332   -2.3054   -1.2364 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7656   -2.0491   -2.0615 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7438   -1.1611   -1.4292 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8457   -0.6731   -0.1817 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3622   -1.9886    8.4050 O   0  0  0  0  0  0  0  0  0  0  0  0
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 25 51  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-09, 2442👍, 0💬