Molecule FYI-1010001

A

Molecule Summary:

ID: FYI-1010001
Names:
InChIKey: DJCDFHLTERHVRN-GFMRDNFCSA-N
SMILES: CCCCCCCCCCC(O)C(O)CCCCC(C)CC(C)/C=C(C)\\C(=O)C(C)C(=O)OC(CO)C(O)C(O)C(=O)O

Received at FYIcenter.com on: 2024-05-24

Molecule ID: FYI-1010001 Edit

Molecule Structure InChIKey: DJCDFHLTERHVRN-GFMRDNFCSA-N

Molecule Structure SMILES String: CCCCCCCCCCC(O)C(O)CCCCC(C)CC(C)/C=C(C)\C(=O)C(C)C(=O)OC(CO)C(O)C(O)C(=O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1010001
FYIcenter.com

 43 42  0  0  0  0  0  0  0  0999 V2000
   30.3109    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   29.0985    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   26.6736    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   25.4612    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2487    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.0363    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.3990    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    9.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   16.9741    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    3.5000    0.0000 O   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  1  0  0  0  0
  5  4  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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 21 20  1  0  0  0  0
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 23 22  2  0  0  0  0
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 40 36  1  0  0  0  0
 41 35  1  0  0  0  0
 42 12  1  0  0  0  0
 43 11  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010001-3D
FYIcenter.com

103102  0  0  1  0  0  0  0  0999 V2000
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 25 27  1  0  0  0  0
 26 88  1  0  0  0  0
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 27 28  2  0  0  0  0
 27 29  1  0  0  0  0
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 29 31  1  0  0  0  0
 29 91  1  0  0  0  0
 30 92  1  0  0  0  0
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 31 32  2  0  0  0  0
 31 33  1  0  0  0  0
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 34 37  1  0  0  0  0
 34 95  1  0  0  0  0
 35 36  1  0  0  0  0
 35 96  1  0  0  0  0
 35 97  1  0  0  0  0
 36 98  1  0  0  0  0
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 37 39  1  0  0  0  0
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 40102  1  0  0  0  0
 41 42  2  0  0  0  0
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 43103  1  0  0  0  0
M  END
$$$$

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2024-06-03, 1740👍, 0💬