Molecule Editor

Molecule ID: FYI-1006270 Edit

Molecule Structure InChIKey: WDOGQTQEKVLZIJ-WAYWQWQTSA-N

Molecule Structure SMILES String: COc2ccc(/C=C\c1cc(OC)c(OC)c(OC)c1)cc2OP(=O)(O)O

Download SDF Download SVG Structure in 2D SDF:

FYI-1006270
FYIcenter.com

 48 49  0  0  0  0  0  0  0  0999 V2000
   13.9326    8.4235    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
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    8.1394    3.4064    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2429    1.7341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4844    9.2597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4844    5.9150    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.3811    7.5873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.7688    9.8718    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.0964    6.9753    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.6911    5.9150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 27 44  1  0  0  0  0
 27 45  1  0  0  0  0
 27 46  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006270-3D
FYIcenter.com

 48 49  0     0  0  0  0  0  0999 V2000
   -1.4866    2.7023    0.8337 P   0  0  0  0  0  0  0  0  0  0  0  0
    3.8054    1.1663    0.9201 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8090   -1.5640   -2.4705 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5432    0.4710   -1.7479 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4791    1.6979    0.0432 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2675    0.1522   -1.4194 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7975    4.1304    0.1389 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0177    2.3352    0.2646 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6255    2.6963    2.3283 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2118   -1.8809   -0.1875 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.5175    0.3456    0.2034 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5771   -2.4220    0.5494 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$