Molecule FYI-1003772

A

Molecule Summary:

ID: FYI-1003772
Names:
InChIKey: GBHRGUHFNYACBB-UHFFFAOYSA-N
SMILES: C1COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC1

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

Molecule ID: FYI-1003772 Edit

Molecule Structure InChIKey: GBHRGUHFNYACBB-UHFFFAOYSA-N

Molecule Structure SMILES String: C1COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003772
FYIcenter.com

 34 34  0  0  0  0  0  0  0  0999 V2000
    0.7630   10.9682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2572    9.6628    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.2866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2572    5.5104    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7630    4.2050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000    3.0146    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4431    1.9800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5603    1.1364    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.1601    0.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 34  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003772-3D
FYIcenter.com

 80 80  0  0  0  0  0  0  0  0999 V2000
   15.8212    5.2262    8.3225 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0298    6.0276    9.3418 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8928    6.9771   10.2642 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.0360    7.6718   11.0854 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9134    8.7971   11.8599 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.6889    9.8316   12.0646 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6748   11.2048   13.1825 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.3987   12.5308   12.5535 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.0755   12.7289   13.0043 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.3182   11.6757   12.4793 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-08-03, 2874👍, 0💬