Molecule Editor

Molecule ID: FYI-1004151 Edit

Molecule Structure InChIKey: MEJAFWXKUKMUIR-FHPNUNMMSA-N

Molecule Structure SMILES String: O=C(O)/C=C/C(=O)O.CC(C)OC(=O)[C@H](C)NP(=O)(CO[C@H](C)Cn2cnc1c(N)ncnc12)Oc3ccccc3

Download SDF Download SVG Structure in 2D SDF:

FYI-1004151
FYIcenter.com

 41 42  0  0  1  0  0  0  0  0999 V2000
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   12.2428   10.0361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6215   10.2793    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7640    8.7206    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.6639    7.6481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1851    6.3325    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.8062    6.0895    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0849    5.2601    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2642   17.0204    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5072   15.6417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8228   15.1628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4348   14.7418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.9168    4.1591    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6188    3.6347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4605   10.6633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3881    9.7634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    9.3424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0725   10.2422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  6  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
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 13 12  1  0  0  0  0
 14 13  2  0  0  0  0
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 16 15  1  0  0  0  0
 15 17  1  1  0  0  0
 18 17  1  6  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 22 21  1  6  0  0  0
 23 22  1  0  0  0  0
 24 22  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  2  0  0  0  0
 28 27  1  0  0  0  0
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 34 33  2  0  0  0  0
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 39 38  2  0  0  0  0
 40 39  1  0  0  0  0
 41 40  2  0  0  0  0
 41 36  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004151-3D
FYIcenter.com

 74 75  0  0  1  0  0  0  0  0999 V2000
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    3.0613   -0.6013    1.6829 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$