Molecule FYI-1009799

A

Molecule Summary:

ID: FYI-1009799
Names:
InChIKey: OCPGSVYCKLXPSO-UHFFFAOYSA-N
SMILES: CC5(O)C(=O)OC4CC3C2CCC1CC(O)CCC1(C)C2CCC3(C)C45

Received at FYIcenter.com on: 2024-05-17

Molecule ID: FYI-1009799 Edit

Molecule Structure InChIKey: OCPGSVYCKLXPSO-UHFFFAOYSA-N

Molecule Structure SMILES String: CC5(O)C(=O)OC4CC3C2CCC1CC(O)CCC1(C)C2CCC3(C)C45

Download SDF Download SVG Structure in 2D SDF:

FYI-1009799
FYIcenter.com

 26 30  0  0  0  0  0  0  0  0999 V2000
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    8.1336    1.9618    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2800    0.5694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5589    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6915    0.8229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5452    2.2153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2662    2.7847    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1199    4.1769    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 25 14  1  0  0  0  0
 26  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1009799-3D
FYIcenter.com

 60 64  0  0  1  0  0  0  0  0999 V2000
    0.6166    1.3213    0.3852 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7403    0.5841    1.1756 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.8499    1.4364    1.3122 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0053    0.0684    2.4279 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8783    0.6231    3.5059 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4449   -1.1445    2.1113 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2024-05-29, 1595👍, 0💬