Molecule FYI-1005733

A

Molecule Summary:

ID: FYI-1005733
Names:
InChIKey: WTQYWNWRJNXDEG-ABSNHQIMSA-N
SMILES: CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3

Received at FYIcenter.com on: 2023-11-11

Molecule ID: FYI-1005733 Edit

Molecule Structure InChIKey: WTQYWNWRJNXDEG-ABSNHQIMSA-N

Molecule Structure SMILES String: CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3

Download SDF Download SVG Structure in 2D SDF:

FYI-1005733
FYIcenter.com

 45 47  0     1  0  0  0  0  0999 V2000
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    5.8864   -1.2185    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4750   -0.6170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8060    3.0061    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    8.2838    1.0576    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    8.5426    2.0235    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    9.6827    0.5488    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
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 21 22  1  0  0  0  0
 21 44  1  0  0  0  0
 22 45  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005733-3D
FYIcenter.com

 45 47  0     1  0  0  0  0  0999 V2000
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   -0.8485   -0.3366   -1.0937 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9364   -0.1331    0.8814 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.3049    0.2750   -1.2959 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.1972   -1.4579    0.1501 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.7100   -1.2068   -1.2816 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5064    0.0045    1.4452 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8131    0.4625   -0.9586 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

✍: FYIcenter.com

2023-11-18, 364👍, 0💬