Molecule FYI-1015723

A

Molecule Summary:

ID: FYI-1015723
Names:
InChIKey: NJGPTZOMDGIQOF-UHFFFAOYSA-N
SMILES: CCCCCCCCCCCCOS(=O)(=O)c2ccc(Oc1ccc(S(=O)(=O)O)cc1)cc2

Received at FYIcenter.com on: 2025-10-01

Molecule ID: FYI-1015723 Edit

Molecule Structure InChIKey: NJGPTZOMDGIQOF-UHFFFAOYSA-N

Molecule Structure SMILES String: CCCCCCCCCCCCOS(=O)(=O)c2ccc(Oc1ccc(S(=O)(=O)O)cc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1015723
FYIcenter.com

 33 34  0  0  0  0  0  0  0  0999 V2000
   22.0114    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.7989    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5865    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3741    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1617    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9493    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7368    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5244    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3119    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4000    1.4000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8000    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 27 26  2  0  0  0  0
 28 27  1  0  0  0  0
 29 28  2  0  0  0  0
 29 24  1  0  0  0  0
 30 27  1  0  0  0  0
 31 30  2  0  0  0  0
 32 30  2  0  0  0  0
 33 30  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015723-3D
FYIcenter.com

 67 68  0  0  0  0  0  0  0  0999 V2000
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   16.0331   -1.2597   -9.1888 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2025-10-14, 558👍, 0💬