Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BNVJ29
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| Binder Name |
(2R)-2-[(2S,3R,4S,5S,6R)-3,5-Dibenzoyloxy-2-[(2R,3R)-1,4-dioxo-1,4-di(propan-2-yloxy)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxybutan-2-yl]oxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-phenylpropanoic acid
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| Synonyms |
CHEMBL3335530; BDBM50026881
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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 |
C45H54O19
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| Canonical SMILES |
C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@H]([C@H](C(=O)OC(C)C)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)OC(=O)C3=CC=CC=C3)O[C@H](CC4=CC=CC=C4)C(=O)O)OC(=O)C5=CC=CC=C5)C(=O)OC(C)C)O)O)O
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| InChI |
1S/C45H54O19/c1-23(2)56-42(54)36(63-44-33(49)32(48)31(47)25(5)58-44)37(43(55)57-24(3)4)64-45-38(62-41(53)28-19-13-8-14-20-28)35(59-29(39(50)51)21-26-15-9-6-10-16-26)34(30(22-46)60-45)61-40(52)27-17-11-7-12-18-27/h6-20,23-25,29-38,44-49H,21-22H2,1-5H3,(H,50,51)/t25-,29+,30+,31+,32+,33-,34-,35-,36+,37+,38+,44-,45-/m0/s1
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| InChIKey |
QZNKJGZQSWELEQ-NAYSPJEYSA-N
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| PubChem Compound ID | ||||
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