Molecule FYI-1010342

A

Molecule Summary:

ID: FYI-1010342
Names:
InChIKey: LAHOZMDSUWLRDY-JNEPIJITSA-N
SMILES: CCC(C(=O)O)C(=O)O[C@@H]8[C@]6(C)Oc5ccc(c2ccc1O[C@]4(C)C(=C(O)c1c2O)C(=O)[C@@H]3O[C@]3(C)[C@@H]4OC(=O)CC(=O)O)c(O)c5C(O)=C6C(=O)[C@@H]7O[C@@]78C

Received at FYIcenter.com on: 2024-06-05

Molecule ID: FYI-1010342 Edit

Molecule Structure InChIKey: LAHOZMDSUWLRDY-JNEPIJITSA-N

Molecule Structure SMILES String: CCC(C(=O)O)C(=O)O[C@@H]8[C@]6(C)Oc5ccc(c2ccc1O[C@]4(C)C(=C(O)c1c2O)C(=O)[C@@H]3O[C@]3(C)[C@@H]4OC(=O)CC(=O)O)c(O)c5C(O)=C6C(=O)[C@@H]7O[C@@]78C

Download SDF Download SVG Structure in 2D SDF:

FYI-1010342
FYIcenter.com

 56 63  0  0  1  0  0  0  0  0999 V2000
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M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1010342-3D
FYIcenter.com

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 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 30 76  1  0  0  0  0
 31 33  1  0  0  0  0
 31 32  2  0  0  0  0
 33 34  1  0  0  0  0
 33 35  1  0  0  0  0
 33 77  1  1  0  0  0
 34 35  1  0  0  0  0
 35 37  1  0  0  0  0
 35 36  1  1  0  0  0
 36 78  1  0  0  0  0
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 37 38  1  0  0  0  0
 37 81  1  6  0  0  0
 38 39  1  0  0  0  0
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 39 41  1  0  0  0  0
 41 42  1  0  0  0  0
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 41 83  1  0  0  0  0
 42 43  2  0  0  0  0
 42 44  1  0  0  0  0
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 55 56  1  1  0  0  0
 56 88  1  0  0  0  0
 56 89  1  0  0  0  0
 56 90  1  0  0  0  0
M  END
$$$$

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2024-07-11, 1216👍, 0💬