Molecule Editor

Molecule ID: FYI-1015599 Edit

Molecule Structure InChIKey: IEHNHZCHTKPEQR-QRQIAZFYSA-N

Molecule Structure SMILES String: FC8(F)CC/C(=C\4/N=C\1CC2=CCC(C3COCC1C23)N5c7nnc4c6COCC5c67)CC8

Download SDF Download SVG Structure in 2D SDF:

FYI-1015599
FYIcenter.com

 33 40  0  0  0  0  0  0  0  0999 V2000
    5.4929    5.9302    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.2001    5.9760    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1316    6.5668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9068    5.8781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0662    4.6686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0340    4.1437    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0379    4.6656    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8895    3.9645    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7264    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4619    0.0206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0770    6.9627    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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  4  3  1  0  0  0  0
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 33  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015599-3D
FYIcenter.com

 59 66  0  0  1  0  0  0  0  0999 V2000
    0.6956    0.3249   -1.8971 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.9737    0.3889   -2.3335 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7473    0.2345   -1.2223 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.2603    1.7057   -3.0007 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4597    1.9050   -4.3812 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2238    1.0562   -6.9990 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0025    0.8171   -8.7838 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3446    3.4475   -8.1347 C   0  0  3  0  0  0  0  0  0  0  0  0
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M  END
$$$$