Molecule Editor

Molecule ID: FYI-1003433 Edit

Molecule Structure InChIKey: OVMFOVNOXASTPA-UHFFFAOYSA-N

Molecule Structure SMILES String: O=c4cc(c1ccc(O)cc1)oc5c(C2OC(CO)C(O)C(O)C2O)c(O)c(C3OCC(O)C(O)C3O)c(O)c45

Download SDF Download SVG Structure in 2D SDF:

FYI-1003433
FYIcenter.com

 40 44  0  0  0  0  0  0  0  0999 V2000
   13.3368    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4869    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2745    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6372    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1243    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  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  6  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  1  0  0  0  0
 10  3  1  0  0  0  0
 11 10  1  0  0  0  0
 12  5  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 18 17  2  0  0  0  0
 19 17  1  0  0  0  0
 19 13  1  0  0  0  0
 20 19  2  0  0  0  0
 21 20  1  0  0  0  0
 22 20  1  0  0  0  0
 23 22  2  0  0  0  0
 23 12  1  0  0  0  0
 24 23  1  0  0  0  0
 25 22  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  1  0  0  0  0
 28 27  1  0  0  0  0
 29 28  1  0  0  0  0
 30 28  1  0  0  0  0
 31 30  1  0  0  0  0
 32 30  1  0  0  0  0
 32 25  1  0  0  0  0
 33 32  1  0  0  0  0
 34 15  1  0  0  0  0
 35 34  2  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
 38 37  1  0  0  0  0
 39 37  1  0  0  0  0
 40 39  2  0  0  0  0
 40 34  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003433-3D
FYIcenter.com

 68 72  0  0  1  0  0  0  0  0999 V2000
   -2.4045    1.6778    0.0950 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.7264   -0.6119   -0.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1732   -1.8349   -0.0758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9992   -3.0623   -0.1700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2467   -3.0551   -0.8211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0203   -4.2154   -0.9336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5406   -5.4051   -0.4053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2556   -6.5613   -0.4989 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3070   -5.4488    0.2315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5378   -4.2835    0.3480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8030   -2.0387   -0.0451 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0467   -0.9580   -0.1738 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4357   -1.2350   -0.2436 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9037   -2.5146    0.4583 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.6259   -2.2909    1.8685 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6335   -1.4836    2.5236 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.0635   -0.9645    3.8444 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0217   -0.0133    3.6007 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8733   -2.3544    2.6741 C   0  0  3  0  0  0  0  0  0  0  0  0
    3.5774   -3.5994    3.3269 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3933   -2.6567    1.2650 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.4296   -3.6537    1.3276 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3007   -3.1686    0.3063 C   0  0  3  0  0  0  0  0  0  0  0  0
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    3.5601   -0.4815   -1.0610 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9068    1.1554   -0.5066 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8846    2.3344   -0.4291 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.5249    3.3644   -1.3751 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2313    3.3021   -2.6234 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7249    3.4835   -2.3786 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.9723    4.7155   -1.6743 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2292    2.3188   -1.5262 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.6167    2.5285   -1.2213 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4225    2.2129   -0.2221 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.8060    1.0899    0.5772 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5226    1.4003   -0.2816 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0491    2.6742   -0.1025 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.7908   -0.4290    0.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7520    3.3410   -0.1099 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
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  3 41  1  0  0  0  0
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  4 12  1  0  0  0  0
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 26 27  1  0  0  0  0
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 27 58  1  0  0  0  0
 28 29  1  0  0  0  0
 28 38  2  0  0  0  0
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 39 68  1  0  0  0  0
M  END
$$$$