Molecule Editor

Molecule ID: FYI-1010128 Edit

Molecule Structure InChIKey: NHXHDQFTVZUNTA-IHDDPFCSSA-N

Molecule Structure SMILES String: CCCC(C)C(=O)OC(CCCCC(C)C(CC)OC)CC(Cc4ccc(O[C@H]3OC(C)[C@@H](O)C(O[C@H]2OC(C)[C@@H](O)C(O[C@H]1OC(C)[C@H](O)C(O)C1OC)C2OC)C3OC)cc4)OC(=O)C(C)CCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1010128
FYIcenter.com

 71 74  0  0  1  0  0  0  0  0999 V2000
   15.7617   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   18.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   14.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7617   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   11.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7617    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.5493    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8498   12.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000   14.0000    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  4  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 14  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 16  1  0  0  0  0
 20 19  1  0  0  0  0
 21  9  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
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 31 30  1  1  0  0  0
 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
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 36 31  1  0  0  0  0
 37 35  1  0  0  0  0
 34 38  1  1  0  0  0
 39 33  1  0  0  0  0
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 41 40  1  0  0  0  0
 42 41  1  0  0  0  0
 43 42  1  0  0  0  0
 44 43  1  0  0  0  0
 45 44  1  0  0  0  0
 45 40  1  0  0  0  0
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 43 47  1  6  0  0  0
 48 42  1  0  0  0  0
 49 48  1  6  0  0  0
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 53 52  1  0  0  0  0
 54 53  1  0  0  0  0
 54 49  1  0  0  0  0
 55 53  1  0  0  0  0
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 57 51  1  0  0  0  0
 58 50  1  0  0  0  0
 59 58  1  0  0  0  0
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 69 67  1  0  0  0  0
 70 69  1  0  0  0  0
 71 70  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010128-3D
FYIcenter.com

161164  0  0  1  0  0  0  0  0999 V2000
   19.7702    3.4390   -6.6035 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.2511    2.1816   -5.9099 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6562    1.1829   -6.9028 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1435   -0.0972   -6.2609 C   0  0  3  0  0  0  0  0  0  0  0  0
   17.0189    0.1451   -5.2395 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.5565   -1.0760   -7.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$