Molecule FYI-1003789

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A

Molecule Summary:

ID: FYI-1003789
Names:
InChIKey: JULWGWNBYFVGDD-UHFFFAOYSA-N
SMILES: C1COCOCOCOCOCOCOCOCOCOCOCOCOCOCO1

Received at FYIcenter.com on: 2023-07-26

Molecule ID: FYI-1003789 Edit

Molecule Structure InChIKey: JULWGWNBYFVGDD-UHFFFAOYSA-N

Molecule Structure SMILES String: C1COCOCOCOCOCOCOCOCOCOCOCOCOCOCO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003789
FYIcenter.com

 31 31  0  0  0  0  0  0  0  0999 V2000
    0.8340   10.2682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2818    8.9816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.6103    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.2103    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2818    4.8390    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8340    3.5524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6337    2.4032    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6484    1.4388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8366    0.6982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1493    0.2120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5332    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9314    0.0708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2868    0.4218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.6508   11.9252    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.2868   13.3987    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9314   13.7497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5332   13.8205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1493   13.6086    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8366   13.1223    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6484   12.3817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6337   11.4173    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  5  4  1  0  0  0  0
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  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
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 16 15  1  0  0  0  0
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 18 17  1  0  0  0  0
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 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 31  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003789-3D
FYIcenter.com

 63 63  0  0  0  0  0  0  0  0999 V2000
   12.9216   -7.6935    7.9233 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5965   -8.8614    8.5146 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1226   -9.3275    9.7505 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8080  -10.0651    9.9661 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0842  -10.6288   11.2200 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.7796  -11.3788   11.2990 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.4122  -10.7922   11.5982 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.5674  -10.5494   10.5640 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1486   -9.7466    9.4545 O   0  0  0  0  0  0  0  0  0  0  0  0
   21.8024  -10.1202    9.4407 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.9014   -9.7317    8.4745 O   0  0  0  0  0  0  0  0  0  0  0  0
   20.9402   -8.3378    8.4166 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.0207   -7.9294    7.4660 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.6938   -7.9140    7.8722 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1643   -6.9169    7.0546 O   0  0  0  0  0  0  0  0  0  0  0  0
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   14.4809   -5.2424    5.1401 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0936   -5.2554    5.1785 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7209   -4.2417    4.2952 O   0  0  0  0  0  0  0  0  0  0  0  0
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 30 63  1  0  0  0  0
M  END
$$$$

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2023-08-09, 2352👍, 0💬