Molecule FYI-1010272

A

Molecule Summary:

ID: FYI-1010272
Names:
InChIKey: AEULNKPXALBIHK-UHFFFAOYSA-N
SMILES: CCC(=O)CCCCCCCCCCCCCOP2(=O)OCC1COC(=O)C1=C(C)O2

Received at FYIcenter.com on: 2024-06-03

Molecule ID: FYI-1010272 Edit

Molecule Structure InChIKey: AEULNKPXALBIHK-UHFFFAOYSA-N

Molecule Structure SMILES String: CCC(=O)CCCCCCCCCCCCCOP2(=O)OCC1COC(=O)C1=C(C)O2

Download SDF Download SVG Structure in 2D SDF:

FYI-1010272
FYIcenter.com

 31 32  0  0  0  0  0  0  0  0999 V2000
   25.1332    5.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.9208    4.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   21.4960    4.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2835    5.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   17.8586    5.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6462    4.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.4337    5.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2213    4.5495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0089    5.2495    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5700    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.6263    3.1534    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0127    0.8634    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  2  0  0  0  0
  5  3  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  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
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 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
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  1  0  0  0  0
 27 26  2  0  0  0  0
 28 26  1  0  0  0  0
 28 23  1  0  0  0  0
 29 28  2  0  0  0  0
 30 29  1  0  0  0  0
 30 19  1  0  0  0  0
 31 29  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010272-3D
FYIcenter.com

 70 71  0  0  1  0  0  0  0  0999 V2000
    1.0500   -0.0691   -0.0283 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.2621    4.5966    4.8906 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2024-07-11, 1453👍, 0💬