Molecule FYI-1001749

A

Molecule Summary:

ID: FYI-1001749
SMILES: C([O-])(=O)[C@H]6(O[C@H](O[C@@H]5([C@H]([C@H](O[C@@H]1(CO[C@H]([C@@H]([C@H]1O)O[C@@H]2([C@H](O)[C@@H](O)[C@H](O)[C@@H](C([O-])=O)O2))O[C@@H]3(CO[C@H]([C@@H]([C@H]3O)O)O[C@@H]4(CO[C@H]([C@@H]([C@H]4O)O)O[R2]))))OC[C@H]5O[R1])O))[C@H](O)[C@@H](O)[C@H](O)6)

Received at FYIcenter.com on: 2022-11-20

Molecule ID: FYI-1001749 Edit

Molecule Structure SMILES String: C([O-])(=O)[C@H]6(O[C@H](O[C@@H]5([C@H]([C@H](O[C@@H]1(CO[C@H]([C@@H]([C@H]1O)O[C@@H]2([C@H](O)[C@@H](O)[C@H](O)[C@@H](C([O-])=O)O2))O[C@@H]3(CO[C@H]([C@@H]([C@H]3O)O)O[C@@H]4(CO[C@H]([C@@H]([C@H]4O)O)O[R2]))))OC[C@H]5O[R1])O))[C@H](O)[C@@H](O)[C@H](O)6)

Download SDF Download SVG Structure in 2D SDF:

FYI-1001749
FYIcenter.com

 63 68  0  0  1  0  0  0  0  0999 V2000
   14.5493   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617   11.9000    0.0000 O   0  5  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
   13.3368   14.7000    0.0000 O   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 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   14.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871   11.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   11.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2747    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    5.6000    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
   10.9120    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.7000    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
   12.1244    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 O   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
    0.0000    0.0000    0.0000 R2  0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   14.7000    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
    9.6995   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   18.9000    0.0000 R1  0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   14.0000    0.0000 O   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
   14.5493   18.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617   16.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   16.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742   14.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  1  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  7  1  6  0  0  0
  8  7  1  6  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 10 11  1  6  0  0  0
 12 11  1  1  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 15  1  0  0  0  0
 17 16  1  0  0  0  0
 17 12  1  0  0  0  0
 17 18  1  6  0  0  0
 16 19  1  1  0  0  0
 20 19  1  1  0  0  0
 21 20  1  0  0  0  0
 21 22  1  1  0  0  0
 23 21  1  0  0  0  0
 23 24  1  6  0  0  0
 25 23  1  0  0  0  0
 25 26  1  1  0  0  0
 27 25  1  0  0  0  0
 27 28  1  6  0  0  0
 29 28  1  0  0  0  0
 30 28  2  0  0  0  0
 31 27  1  0  0  0  0
 31 20  1  0  0  0  0
 15 32  1  6  0  0  0
 33 32  1  6  0  0  0
 34 33  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  1  0  0  0  0
 38 37  1  0  0  0  0
 38 33  1  0  0  0  0
 38 39  1  1  0  0  0
 37 40  1  6  0  0  0
 36 41  1  1  0  0  0
 42 41  1  1  0  0  0
 43 42  1  0  0  0  0
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 47 48  1  6  0  0  0
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 45 50  1  6  0  0  0
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 52 10  1  0  0  0  0
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 54 53  1  0  0  0  0
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 54 55  1  1  0  0  0
 56 55  1  0  0  0  0
  9 57  1  1  0  0  0
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 58 59  1  6  0  0  0
 60 58  1  0  0  0  0
 60 61  1  1  0  0  0
 62 60  1  0  0  0  0
 62 63  1  6  0  0  0
 62  4  1  0  0  0  0
M  END
$$$$

Molecule Structure in 3D: Not available

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2022-12-14, 879👍, 0💬