Molecule FYI-1002252

A

Molecule Summary:

ID: FYI-1002252
Names:
InChIKey: AEPWOQFZFIESFV-UHFFFAOYSA-N
SMILES: CC1=CC(=O)C7c5c1c2C(C)=CC(=O)C8c2c6c3c(c(O)cc(C)c3c4c(C)cc(O)c(c4c56)C7O)C8O

Received at FYIcenter.com on: 2023-02-12

Molecule ID: FYI-1002252 Edit

Molecule Structure InChIKey: AEPWOQFZFIESFV-UHFFFAOYSA-N

Molecule Structure SMILES String: CC1=CC(=O)C7c5c1c2C(C)=CC(=O)C8c2c6c3c(c(O)cc(C)c3c4c(C)cc(O)c(c4c56)C7O)C8O

Download SDF Download SVG Structure in 2D SDF:

FYI-1002252
FYIcenter.com

 38 45  0  0  0  0  0  0  0  0999 V2000
    8.4870    9.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.4870    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  4  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  8  2  1  0  0  0  0
  9  8  1  0  0  0  0
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 35 34  1  0  0  0  0
 36 27  1  0  0  0  0
 37 22  1  0  0  0  0
 38 15  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002252-3D
FYIcenter.com

 62 69  0  0  1  0  0  0  0  0999 V2000
    7.2652   -1.9955   -5.3897 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-03-07, 497👍, 0💬