Molecule FYI-1004169

A

Molecule Summary:

ID: FYI-1004169
Names:
InChIKey: SMLJDEUHEIJCNJ-UHFFFAOYSA-N
SMILES: CC2C(=O)CC1C3(C)CCC1(C(C)C(=O)O[Si](C)(C)C)C(=O)C23

Received at FYIcenter.com on: 2023-08-19

Molecule ID: FYI-1004169 Edit

Molecule Structure InChIKey: SMLJDEUHEIJCNJ-UHFFFAOYSA-N

Molecule Structure SMILES String: CC2C(=O)CC1C3(C)CCC1(C(C)C(=O)O[Si](C)(C)C)C(=O)C23

Download SDF Download SVG Structure in 2D SDF:

FYI-1004169
FYIcenter.com

 23 25  0  0  0  0  0  0  0  0999 V2000
   10.4513    2.5802    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1760    2.2213    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8565    3.4554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6811    4.0668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4848    5.3769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7365    3.1378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2788    1.3705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4542    0.7592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6383    2.1487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3281    1.9524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5400    0.6123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8224    0.9446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7514    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 22 20  1  0  0  0  0
 23 20  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004169-3D
FYIcenter.com

 51 53  0  0  1  0  0  0  0  0999 V2000
    0.9269   -0.0082   -0.6013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4666    0.0128   -0.5877 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.9212   -0.6889    0.7052 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7102   -1.8796    0.9066 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6556    0.1775    1.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1234    1.6607    1.5024 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.5934    1.5002    0.0313 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.4373    0.4814   -0.7220 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4975    2.7659    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6163    3.9004    0.4205 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3695    3.1942    1.0351 C   0  0  3  0  0  0  0  0  0  0  0  0
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 23 51  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-25, 1924👍, 0💬