Molecule FYI-1003372

A

Molecule Summary:

ID: FYI-1003372
Names:
InChIKey: CICCYHMSMANUGA-UHFFFAOYSA-N
SMILES: O=C1CCCCC(=O)OCCCCOC(=O)CCCCC(=O)OCCCCO1

Received at FYIcenter.com on: 2023-06-07

Molecule ID: FYI-1003372 Edit

Molecule Structure InChIKey: CICCYHMSMANUGA-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C1CCCCC(=O)OCCCCOC(=O)CCCCC(=O)OCCCCO1

Download SDF Download SVG Structure in 2D SDF:

FYI-1003372
FYIcenter.com

 28 28  0  0  0  0  0  0  0  0999 V2000
    6.8809    2.2725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7024    1.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1118    0.2943    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4403    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3594    1.0033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9502    2.3011    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8693    3.3045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4600    4.6022    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3793    5.6056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7079    5.3111    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6558    8.0808    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.9239    8.9572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.0193    2.9361    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2013    2.1858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
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 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 28 22  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003372-3D
FYIcenter.com

 60 60  0     0  0  0  0  0  0999 V2000
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   -1.7561   -2.3641    0.4954 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9602   -0.7441   -1.5809 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5440   -0.9760    1.9936 O   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-07-01, 1318👍, 0💬