Binder Information
Binder General Information | Top | |||
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Binder ID |
B9L1JY
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Binder Name |
Chembl173041
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Synonyms |
CHEMBL3215449; BDBM50098170
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C46H72NNaO21
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Canonical SMILES |
C[C@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@@H]2[C@@H]([C@@H](O[C@H]([C@H]2O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@H](CC4CCCCC4)C(=O)[O-])O)CO)OCCCCCCCCC(=O)OC)NC(=O)C5=CC(=C(C=C5)OC)OC)O)O)O.[Na+]
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InChI |
1S/C46H73NO21.Na/c1-24-34(51)36(53)37(54)45(63-24)68-40-33(47-42(56)26-17-18-27(59-2)28(21-26)60-3)44(62-19-13-8-6-5-7-12-16-32(50)61-4)66-31(23-49)39(40)67-46-38(55)41(35(52)30(22-48)65-46)64-29(43(57)58)20-25-14-10-9-11-15-25;/h17-18,21,24-25,29-31,33-41,44-46,48-49,51-55H,5-16,19-20,22-23H2,1-4H3,(H,47,56)(H,57,58);/q;+1/p-1/t24-,29-,30-,31-,33-,34+,35-,36-,37-,38-,39+,40+,41-,44+,45-,46-;/m0./s1
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InChIKey |
ONYYQWJKGMEMIL-GRKCLMKLSA-M
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PubChem Compound ID |
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