Molecule FYI-1005282

A

Molecule Summary:

ID: FYI-1005282
Names:
InChIKey: QQODTMFSCVUYDT-XFQBFSSDSA-N
SMILES: CO[C@H]6CC[C@@]5(C)C(=CC[C@H]4C3CC[C@]2(O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C)C(O)C3CC45)C6

Received at FYIcenter.com on: 2023-10-21

Molecule ID: FYI-1005282 Edit

Molecule Structure InChIKey: QQODTMFSCVUYDT-XFQBFSSDSA-N

Molecule Structure SMILES String: CO[C@H]6CC[C@@]5(C)C(=CC[C@H]4C3CC[C@]2(O[C@@H]1C[C@H](C)CN[C@H]1[C@H]2C)C(O)C3CC45)C6

Download SDF Download SVG Structure in 2D SDF:

FYI-1005282
FYIcenter.com

 31 36  0  0  1  0  0  0  0  0999 V2000
    1.3694    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3074    1.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6786    0.7503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8741    2.3749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8121    3.4167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1833    3.1252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7501    4.4583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6165    1.7920    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9876    1.5005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9256    2.5423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4925    3.8755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1933    5.0895    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1213    4.1670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9748    5.5610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2554    6.1312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6886    7.4643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7342    8.4308    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0597    7.7558    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.3929    8.1890    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3929    9.5907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4346   10.5287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1432   11.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1849   12.8379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8100   12.3331    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7682   11.3952    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5645    5.3809    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0597   10.0240    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9977    6.7141    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2358    8.8899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8667    9.0405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.2911    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  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  7  1  1  0  0  0
  8  6  1  0  0  0  0
  8  3  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  6  0  0  0
 12 15  1  0  0  0  0
 13 11  1  0  0  0  0
 13  6  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
 18 16  1  0  0  0  0
 18 19  1  1  0  0  0
 20 19  1  1  0  0  0
 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 22 23  1  1  0  0  0
 24 22  1  0  0  0  0
 25 24  1  0  0  0  0
 12 11  1  0  0  0  0
 27 20  1  0  0  0  0
 27 25  1  6  0  0  0
 12 26  1  0  0  0  0
 29 27  1  0  0  0  0
 29 18  1  0  0  0  0
 29 30  1  6  0  0  0
 28 18  1  0  0  0  0
 26 28  1  0  0  0  0
  1 31  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005282-3D
FYIcenter.com

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