Molecule FYI-1005620

A

Molecule Summary:

ID: FYI-1005620
Names:
InChIKey: NIKHGUQULKYIGE-XSBFNCLBSA-N
SMILES: C=C3C[C@@]24CC[C@@H]1[C@@](C)(C(=O)O)CCC[C@]1(C)[C@@H]2CC[C@@H]3C4

Received at FYIcenter.com on: 2023-11-08

Molecule ID: FYI-1005620 Edit

Molecule Structure InChIKey: NIKHGUQULKYIGE-XSBFNCLBSA-N

Molecule Structure SMILES String: C=C3C[C@@]24CC[C@@H]1[C@@](C)(C(=O)O)CCC[C@]1(C)[C@@H]2CC[C@@H]3C4

Download SDF Download SVG Structure in 2D SDF:

FYI-1005620
FYIcenter.com

 22 25  0  0  1  0  0  0  0  0999 V2000
    6.1283    5.4694    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0110    4.1059    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005620-3D
FYIcenter.com

 52 55  0  0  1  0  0  0  0  0999 V2000
    2.2084   -6.5729   -1.2118 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2587   -5.2630   -1.5079 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0507   -4.4475   -1.9489 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3893   -3.1160   -1.2353 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -1.0671   -2.4010   -0.1360 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.5484   -2.0683    0.2433 C   0  0  1  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-11-13, 2602👍, 0💬