Molecule FYI-1016825

A

Molecule Summary:

ID: FYI-1016825
Names:
InChIKey: CWHJXWHIYGDTGS-UHFFFAOYSA-N
SMILES: O=C(O)c2ccc(C(=O)OCCOC(=O)c1ccc(C(=O)OCCOCCO)cc1)cc2

Received at FYIcenter.com on: 2026-03-18

Molecule ID: FYI-1016825 Edit

Molecule Structure InChIKey: CWHJXWHIYGDTGS-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C(O)c2ccc(C(=O)OCCOC(=O)c1ccc(C(=O)OCCOCCO)cc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1016825
FYIcenter.com

 32 33  0  0  0  0  0  0  0  0999 V2000
   27.8860    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   26.6735    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   25.4611    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
   23.0362    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.8238    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6113    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.6113    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3990    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5493    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.6287    0.3528    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9990    0.0660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.8874    0.4896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   24.2654    0.2423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 28 27  1  0  0  0  0
 19 29  2  0  0  0  0
 29 30  1  0  0  0  0
 16 30  2  0  0  0  0
  7 31  2  0  0  0  0
 31 32  1  0  0  0  0
 32  4  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016825-3D
FYIcenter.com

 54 55  0  0  0  0  0  0  0  0999 V2000
   -0.7354   -0.3126    0.9385 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1085   -0.9869    1.8810 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1632   -1.8275    1.8205 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4736   -0.9192    3.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0884    0.2909    3.6460 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7106    0.3668    4.8871 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7920   -0.7659    5.7113 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4906   -0.6481    7.0262 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9941    0.3919    7.4198 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4868   -1.8327    7.6961 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1576   -1.8306    8.9734 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.6913   -3.0558   11.7041 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6477   -3.1582   15.5496 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1555   -2.1920   16.0914 O   0  0  0  0  0  0  0  0  0  0  0  0
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 24 25  1  0  0  0  0
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 30 52  1  0  0  0  0
 31 32  1  0  0  0  0
 31 53  1  0  0  0  0
 32 54  1  0  0  0  0
M  END
$$$$

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2026-04-13, 451👍, 0💬