Molecule FYI-1007061

Molecule Summary:

ID: FYI-1007061
Names:
InChIKey: SEOQBBBXLPNBFL-PDOUMABYSA-N
SMILES: C[C@@H]2CN[C@H]1[C@@H](C)CO[C@@H]1C2.CC4CCC3C[C@H]2[C@@H](CC=C1C[C@@H](O)CC[C@@]12C)C3CC4

Received at FYIcenter.com on: 2024-01-28

Molecule ID: FYI-1007061 Edit

Molecule Structure InChIKey: SEOQBBBXLPNBFL-PDOUMABYSA-N

Molecule Structure SMILES String: C[C@@H]2CN[C@H]1[C@@H](C)CO[C@@H]1C2.CC4CCC3C[C@H]2[C@@H](CC=C1C[C@@H](O)CC[C@@]12C)C3CC4

Download SDF Download SVG Structure in 2D SDF:

FYI-1007061
FYIcenter.com

 32 36  0  0  1  0  0  0  0  0999 V2000
    2.6566   15.3183    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1608   12.9464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7282   11.6149    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3588   11.3238    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8118    4.5305    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1028    5.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8903    6.5999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2041    4.6768    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1033    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8066    7.9974    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6618    8.8032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3180    8.4106    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7870    7.1152    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4688    5.8924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  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  8  1  6  0  0  0
  4  8  1  1  0  0  0
  6  9  1  6  0  0  0
  5 10  1  6  0  0  0
 11 10  1  0  0  0  0
 11  2  1  0  0  0  0
  6  7  1  0  0  0  0
 13 12  1  0  0  0  0
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 17 16  1  0  0  0  0
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 12 31  1  0  0  0  0
 24 27  1  0  0  0  0
 29 32  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007061-3D
FYIcenter.com

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