Molecule FYI-1016082

A

Molecule Summary:

ID: FYI-1016082
Names:
InChIKey: WVKXFBYBSIJUBM-IHZSPXKISA-N
SMILES: C/C(=C\\C(=O)O/C=C/F)CC[C@H]2[C@](C)(O)CC[C@H]1C(C)(C)CCC[C@@]12C

Received at FYIcenter.com on: 2025-11-13

Molecule ID: FYI-1016082 Edit

Molecule Structure InChIKey: WVKXFBYBSIJUBM-IHZSPXKISA-N

Molecule Structure SMILES String: C/C(=C\C(=O)O/C=C/F)CC[C@H]2[C@](C)(O)CC[C@H]1C(C)(C)CCC[C@@]12C

Download SDF Download SVG Structure in 2D SDF:

FYI-1016082
FYIcenter.com

 26 27  0  0  1  0  0  0  0  0999 V2000
    6.2497    6.8124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2497    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4622    4.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6746    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8871    4.7124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6746    6.8124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0373    4.7124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8248    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4000    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.8248    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5768    8.3163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9621    8.5191    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 22 23  1  6  0  0  0
  6 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016082-3D
FYIcenter.com

 61 62  0  0  1  0  0  0  0  0999 V2000
    3.3073    6.7697    0.6290 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2643    5.8907    1.4161 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7675    6.1853    2.6268 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5271    7.4701    3.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1944    8.5210    2.8339 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7639    7.2417    4.6774 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5213    8.3346    5.5109 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7558    8.2864    6.8179 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5110    9.3402    7.6167 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.6246    4.6703    0.5964 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5085    3.4688    1.0102 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5264    2.3848   -0.1518 C   0  0  1  0  0  0  0  0  0  0  0  0
    6.0530    2.9444   -1.5426 C   0  0  2  0  0  0  0  0  0  0  0  0
    7.4989    3.4743   -1.5172 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1858    4.0018   -1.9865 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8738    1.9122   -2.6572 C   0  0  0  0  0  0  0  0  0  0  0  0
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  3 30  1  0  0  0  0
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 25 26  1  1  0  0  0
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M  END
$$$$

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