Molecule FYI-1003429

A

Molecule Summary:

ID: FYI-1003429
Names:
InChIKey: OTOXYYMXFXPZII-UHFFFAOYSA-N
SMILES: CC(=O)OC1=CC(=CC(=C1)OC2=C(C=C(C3=C2OC4=C(C=C5C(=C4O3)C6=C(O5)C=C(C=C6OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Received at FYIcenter.com on: 2023-06-16

Molecule ID: FYI-1003429 Edit

Molecule Structure InChIKey: OTOXYYMXFXPZII-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(=O)OC1=CC(=CC(=C1)OC2=C(C=C(C3=C2OC4=C(C=C5C(=C4O3)C6=C(O5)C=C(C=C6OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Download SDF Download SVG Structure in 2D SDF:

FYI-1003429
FYIcenter.com

 84 89  0     0  0  0  0  0  0999 V2000
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M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003429-3D
FYIcenter.com

 84 89  0  0  0  0  0  0  0  0999 V2000
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    2.3407   -2.4257   12.1879 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9050   -1.8482   -0.4977 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1058   -3.5465   -0.0564 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.3925   -2.4123    0.3377 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.6661    4.3987    1.4754 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.0009    2.7457    2.0753 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5519    4.1516    2.9708 H   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4919    9.3666    4.2265 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6851    9.4349    2.6237 H   0  0  0  0  0  0  0  0  0  0  0  0
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 56 84  1  0  0  0  0
M  END
$$$$

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2023-07-01, 1519👍, 0💬