Molecule FYI-1006530

A

Molecule Summary:

ID: FYI-1006530
Names:
InChIKey: NYWGYGGFNSPMLY-AHLOSMIKSA-N
SMILES: CCCCC(C)[C@@H](O)C(O)CC(C)C[C@H](O)CCCC[C@@H](O)CC(O)C(C)=O

Received at FYIcenter.com on: 2023-12-31

Molecule ID: FYI-1006530 Edit

Molecule Structure InChIKey: NYWGYGGFNSPMLY-AHLOSMIKSA-N

Molecule Structure SMILES String: CCCCC(C)[C@@H](O)C(O)CC(C)C[C@H](O)CCCC[C@@H](O)CC(O)C(C)=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1006530
FYIcenter.com

 28 27  0  0  0  0  0  0  0  0999 V2000
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    3.8815    2.0994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0940    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3064    2.0994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5189    1.3994    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7313    2.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9437    1.3995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1561    2.0995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3686    1.3995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5810    2.0996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7125    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3300    3.4936    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.3820   10.0970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5260   10.9039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3993   12.2981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7927    5.9853    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9974    6.0658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0938    8.4832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.9308    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  2  0  0  0  0
  9 13  1  0  0  0  0
  7 14  1  1  0  0  0
  2 15  1  1  0  0  0
  1 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
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 23 24  1  0  0  0  0
 19 25  1  1  0  0  0
 18 26  1  0  0  0  0
 20 27  1  0  0  0  0
 16 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006530-3D
FYIcenter.com

 72 71  0  0  1  0  0  0  0  0999 V2000
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    9.3112   -7.5043   -6.7905 H   0  0  0  0  0  0  0  0  0  0  0  0
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 23 24  1  0  0  0  0
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 26 28  2  0  0  0  0
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 27 72  1  0  0  0  0
M  END
$$$$

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