Molecule FYI-1005021

A

Molecule Summary:

ID: FYI-1005021
Names:
InChIKey: BAHCCQLENRKGQZ-SKHCUOGJSA-N
SMILES: CCCCC/C=C/C/C=C/CCCCCCCCC2(CCCCCCCC/C=C/C/C=C/CCCCC)OC1CC(CN(C)C(C)O)CC1O2

Received at FYIcenter.com on: 2023-10-09

Molecule ID: FYI-1005021 Edit

Molecule Structure InChIKey: BAHCCQLENRKGQZ-SKHCUOGJSA-N

Molecule Structure SMILES String: CCCCC/C=C/C/C=C/CCCCCCCCC2(CCCCCCCC/C=C/C/C=C/CCCCC)OC1CC(CN(C)C(C)O)CC1O2

Download SDF Download SVG Structure in 2D SDF:

FYI-1005021
FYIcenter.com

 50 51  0  0  0  0  0  0  0  0999 V2000
   29.1927   19.4452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   27.9802   20.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   25.5554   20.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.3430   19.4452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.1304   20.1452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9180   19.4452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6372   14.4909    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
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  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
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 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 19  1  0  0  0  0
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 49 39  1  0  0  0  0
 50 49  1  0  0  0  0
 50 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005021-3D
FYIcenter.com

133134  0  0  1  0  0  0  0  0999 V2000
   15.1515    9.1342    3.6131 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1412    8.1949    4.2523 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-11-09, 384👍, 0💬