Molecule Editor

Molecule ID: FYI-1008190 Edit

Molecule Structure InChIKey: HSIKXXMSMBBCHO-HXUWFJFHSA-N

Molecule Structure SMILES String: CC[N+](CC)(CC)CC[C@@](O)(c2ccc1OCOc1c2)N3CCNCC3

Download SDF Download SVG Structure in 2D SDF:

FYI-1008190
FYIcenter.com

 26 28  0  0  1  0  0  0  0  0999 V2000
   10.8567    3.6551    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4055    3.6551    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.4055    2.2399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8637    1.3676    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4055    5.0704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5447    5.8334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1798    4.3627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.2929    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5756    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9831    0.1479    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 18 10  1  0  0  0  0
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 26 25  2  0  0  0  0
 26 18  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008190-3D
FYIcenter.com

 60 62  0  0  1  0  0  0  0  0999 V2000
    2.7774    0.3080    1.2991 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4422    0.2767   -0.1899 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8867   -1.0242   -0.9306 N   0  3  0  0  0  0  0  0  0  0  0  0
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    4.4358   -1.0971   -0.8451 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0892   -2.3034   -1.5444 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6486   -2.2173   -1.3999 C   0  0  1  0  0  0  0  0  0  0  0  0
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M  END
$$$$