Molecule FYI-1014906

A

Molecule Summary:

ID: FYI-1014906
Names:
InChIKey: JZRGDONPOCTWIV-BJDJZHNGSA-N
SMILES: CC(O)c2cc1cc(C(C)O)c(C(C)O)cc1cc2C(C)O

Received at FYIcenter.com on: 2025-06-07

Molecule ID: FYI-1014906 Edit

Molecule Structure InChIKey: JZRGDONPOCTWIV-BJDJZHNGSA-N

Molecule Structure SMILES String: CC(O)c2cc1cc(C(C)O)c(C(C)O)cc1cc2C(C)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1014906
FYIcenter.com

 46 47  0  0  1  0  0  0  0  0999 V2000
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    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
    6.0622    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   10.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 17  2  1  0  0  0  0
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 21 26  1  0  0  0  0
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 25 18  1  0  0  0  0
 27  3  1  0  0  0  0
 28  6  1  0  0  0  0
 29  7  1  0  0  0  0
 30 10  1  0  0  0  0
 32 13  1  0  0  0  0
 34 13  1  0  0  0  0
 40 19  1  0  0  0  0
 42 19  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014906-3D
FYIcenter.com

 46 47  0  0  1  0  0  0  0  0999 V2000
    3.1620    0.0519   -1.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5348    0.1726    0.0606 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.1191    0.2553   -0.0592 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9369   -0.8996    1.0684 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6180   -0.4426    2.2286 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0195   -1.3056    3.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7385   -0.8751    4.3989 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1490   -1.7638    5.4224 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0001   -1.2525    6.5720 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.9634   -0.1174    6.2196 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1462   -0.8339    7.6300 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7466   -3.1196    5.3373 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2071   -5.4375    5.8358 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7001   -2.6592    3.1602 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2025-06-21, 180👍, 0💬