Molecule FYI-1004889

A

Molecule Summary:

ID: FYI-1004889
Names:
InChIKey: PVMGKOCTYGNUPK-UHFFFAOYSA-N
SMILES: COc3cc2C/C(=N/c1cc(OC)c(O)c(OC)c1)Nc2cc3O

Received at FYIcenter.com on: 2023-09-26

Molecule ID: FYI-1004889 Edit

Molecule Structure InChIKey: PVMGKOCTYGNUPK-UHFFFAOYSA-N

Molecule Structure SMILES String: COc3cc2C/C(=N/c1cc(OC)c(O)c(OC)c1)Nc2cc3O

Download SDF Download SVG Structure in 2D SDF:

FYI-1004889
FYIcenter.com

 24 26  0  0  0  0  0  0  0  0999 V2000
    6.9279    6.2088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7154    6.9088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7154    8.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9279    9.0088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1403    8.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.4366    4.6780    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4999    3.6376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.5029   10.4087    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5652    8.3088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 21 22  1  0  0  0  0
  9 23  1  0  0  0  0
  8 24  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004889-3D
FYIcenter.com

 42 44  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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  6 30  1  0  0  0  0
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 23 24  1  0  0  0  0
 24 42  1  0  0  0  0
M  END
$$$$

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2023-10-15, 2552👍, 0💬