Molecule FYI-1001528

A

Molecule Summary:

ID: FYI-1001528
SMILES: O[C@H]5CC[C@]1(C(OO4)(C5)C=CC24C1CC[C@]3(C2CC[C@@H]3[C@@H](/C=C/[C@@H](C(C)C)C)C)C)C

Received at FYIcenter.com on: 2022-08-28

Molecule ID: FYI-1001528 Edit

Molecule Structure SMILES String: O[C@H]5CC[C@]1(C(OO4)(C5)C=CC24C1CC[C@]3(C2CC[C@@H]3[C@@H](/C=C/[C@@H](C(C)C)C)C)C)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1001528
FYIcenter.com

 31 35  0  0  1  0  0  0  0  0999 V2000
    9.5851    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1711    1.2742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8607    1.5527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4470    2.8203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3393    4.0043    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6536    3.5438    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2076    3.4927    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8078    4.7400    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0675    2.2697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5499    4.5394    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1360    5.8135    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8255    6.0920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0242    4.9545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6150    5.3804    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2048    6.6491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1012    7.6447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4115    7.3662    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0814    8.5264    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1850    9.5219    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9612    8.9770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8009    9.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6408    8.9770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4806    9.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3204    8.9770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1602    9.6469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1602   10.9865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.9770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3204    7.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8009   10.9865    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8270    8.0587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1076    4.2507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  6  1  0  0  0  0
  9  2  1  0  0  0  0
 10  6  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 12  8  1  0  0  0  0
 13 12  1  0  0  0  0
 13  5  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 17 12  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  1  0  0  0
 20 16  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 25  1  0  0  0  0
 24 28  1  6  0  0  0
 21 29  1  1  0  0  0
 16 30  1  1  0  0  0
  5 31  1  1  0  0  0
M  END
$$$$

Molecule Structure in 3D: Not available

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2022-10-01, 1945👍, 0💬