Molecule FYI-1005304

A

Molecule Summary:

ID: FYI-1005304
Names:
InChIKey: KMTPRGDMPLDMRH-UHFFFAOYSA-N
SMILES: COc5ccc(c4cc(=O)c3cc(OC)c(C1CC2CCC1(C)C2(C)C)cc3o4)cc5OC

Received at FYIcenter.com on: 2023-10-23

Molecule ID: FYI-1005304 Edit

Molecule Structure InChIKey: KMTPRGDMPLDMRH-UHFFFAOYSA-N

Molecule Structure SMILES String: COc5ccc(c4cc(=O)c3cc(OC)c(C1CC2CCC1(C)C2(C)C)cc3o4)cc5OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1005304
FYIcenter.com

 33 37  0  0  0  0  0  0  0  0999 V2000
    6.7117    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7117    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4992    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4992    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 30 32  1  0  0  0  0
 20 33  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005304-3D
FYIcenter.com

 65 69  0  0  1  0  0  0  0  0999 V2000
    1.2904   -1.0360    0.2235 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4525   -0.2339    0.0354 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.0330   -0.5416    2.3728 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6830   -0.0842    3.5240 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4079    1.1100    3.5093 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0312    1.6259    4.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8487    3.4176    6.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

✍: FYIcenter.com

2023-11-02, 1674👍, 0💬