Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BQ76IC
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| Binder Name |
(2R)-2-[[(2S,3S)-4-[(E)-3-[(1R)-1-Carboxy-2-(3,4-dihydroxyphenyl)ethoxy]-3-oxoprop-1-enyl]-2-(3,4-dihydroxyphenyl)-6-hydroxy-2,3-dihydro-1-benzofuran-3-yl]-hydroxymethoxy]-3-(3,4-dihydroxyphenyl)propanoic acid
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| Synonyms |
CHEMBL541265
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| Binder Type |
Small molecular drug
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| Structure |
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Download2D MOL
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| Formula |
C36H32O16
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| Canonical SMILES |
C1=CC(=C(C=C1C[C@H](C(=O)O)OC([C@@H]2[C@H](OC3=CC(=CC(=C23)/C=C/C(=O)O[C@H](CC4=CC(=C(C=C4)O)O)C(=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O
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| InChI |
1S/C36H32O16/c37-20-13-18(4-8-30(44)50-28(34(45)46)11-16-1-5-21(38)24(41)9-16)31-27(15-20)51-33(19-3-7-23(40)26(43)14-19)32(31)36(49)52-29(35(47)48)12-17-2-6-22(39)25(42)10-17/h1-10,13-15,28-29,32-33,36-43,49H,11-12H2,(H,45,46)(H,47,48)/b8-4+/t28-,29-,32+,33-,36?/m1/s1
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| InChIKey |
YLSNESYAOIRZEA-AVPWDRFWSA-N
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| PubChem Compound ID | ||||
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