Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BAW47B
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| Binder Name |
2,3,4,5-Tetra(3,4,5-trihydroxyphenylcarbonyloxy)-6-(3,4,5-trihydroxyphenylcarbonyloxymethyl)-(2R,3S,4R,5S,6S)-tetrahydro-2H-pyran
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| Synonyms |
CHEMBL127911; BDBM50135166; ZINC169316285; 1-O,2-O,3-O,4-O,6-O-Pentagalloyl-beta-L-glucopyranose
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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 |
C41H32O26
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| Canonical SMILES |
C1=C(C=C(C(=C1O)O)O)C(=O)OC[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)OC(=O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O)OC(=O)C6=CC(=C(C(=C6)O)O)O
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| InChI |
1S/C41H32O26/c42-17-1-12(2-18(43)28(17)52)36(57)62-11-27-33(64-37(58)13-3-19(44)29(53)20(45)4-13)34(65-38(59)14-5-21(46)30(54)22(47)6-14)35(66-39(60)15-7-23(48)31(55)24(49)8-15)41(63-27)67-40(61)16-9-25(50)32(56)26(51)10-16/h1-10,27,33-35,41-56H,11H2/t27-,33-,34+,35-,41+/m0/s1
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| InChIKey |
QJYNZEYHSMRWBK-ABGQCZQLSA-N
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| PubChem Compound ID | ||||
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