Molecule FYI-1011840

A

Molecule Summary:

ID: FYI-1011840
Names:
InChIKey: BGAILLKFXBSPRD-UHFFFAOYSA-N
SMILES: C/C(C)=C\\CCC(C)CCOC1OC(CO)C(O)C(O)C1O

Received at FYIcenter.com on: 2024-08-11

Molecule ID: FYI-1011840 Edit

Molecule Structure InChIKey: BGAILLKFXBSPRD-UHFFFAOYSA-N

Molecule Structure SMILES String: C/C(C)=C\CCC(C)CCOC1OC(CO)C(O)C(O)C1O

Download SDF Download SVG Structure in 2D SDF:

FYI-1011840
FYIcenter.com

 22 22  0  0  0  0  0  0  0  0999 V2000
    8.4871    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 22 13  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1011840-3D
FYIcenter.com

 52 52  0  0  1  0  0  0  0  0999 V2000
    0.9883    0.1603   -0.7809 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4825    0.1965   -0.9452 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0918    1.4922   -1.4203 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2246   -0.8815   -0.6681 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7269   -0.8933   -0.7342 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3024   -1.9030   -1.7262 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8464   -1.8491   -1.7561 C   0  0  3  0  0  0  0  0  0  0  0  0
    7.4492   -2.1598   -0.3776 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.3679   -3.6799   -3.9091 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8023   -3.6664   -3.9807 C   0  0  3  0  0  0  0  0  0  0  0  0
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 22 52  1  0  0  0  0
M  END
$$$$

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