Molecule Editor

Molecule ID: FYI-1004072 Edit

Molecule Structure InChIKey: PRYHOGCYPICMAJ-SSXBUVCOSA-O

Molecule Structure SMILES String: CC[C@@H]5CN4CCc2c([nH]c3cccc([OH+][C@H]1O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]1O)c23)[C@@H]4C[C@@H]5/C(=C\OC)C(=O)OC

Download SDF Download SVG Structure in 2D SDF:

FYI-1004072
FYIcenter.com

 40 44  0  0  1  0  0  0  0  0999 V2000
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    9.8513    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6389    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6389    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4264    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.6389    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8513    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.0637    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  4  3  1  0  0  0  0
  5  3  1  0  0  0  0
  5  6  1  1  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
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 40 39  2  0  0  0  0
 40 22  1  0  0  0  0
 19 40  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004072-3D
FYIcenter.com

 77 81  0  0  1  0  0  0  0  0999 V2000
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    1.9026   12.0750   -8.9344 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$