Molecule FYI-1007243

A

Molecule Summary:

ID: FYI-1007243
Names:
InChIKey: MCWIZGOCDUYGIV-VTBUGJKMSA-N
SMILES: C=C[C@]3(C)CCC1C(=CC(=O)C2[C@@](C)(C(=O)O)CCC[C@]12C)C3

Received at FYIcenter.com on: 2024-02-10

Molecule ID: FYI-1007243 Edit

Molecule Structure InChIKey: MCWIZGOCDUYGIV-VTBUGJKMSA-N

Molecule Structure SMILES String: C=C[C@]3(C)CCC1C(=CC(=O)C2[C@@](C)(C(=O)O)CCC[C@]12C)C3

Download SDF Download SVG Structure in 2D SDF:

FYI-1007243
FYIcenter.com

 23 25  0  0  0  0  0  0  0  0999 V2000
    2.4249    3.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.6156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    5.3156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.6156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.5156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.5156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.2156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.6156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.3156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4564    6.0153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.9989    8.3070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 18 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007243-3D
FYIcenter.com

 51 53  0  0  1  0  0  0  0  0999 V2000
    3.9597    0.6881   -1.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0013    0.7428   -2.7545 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1968    0.1475   -4.2461 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.6891    1.6214   -4.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3537    0.0741   -5.6106 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9030    0.4862   -5.4555 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0914   -0.6035   -4.7286 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.9066   -1.0322   -3.5124 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3613   -1.3288   -2.3287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0819   -1.2767   -2.0925 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2024-02-18, 940👍, 0💬