Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BD04NS
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| Binder Name |
2-Hydroxy-5-[4-[4-[[(2R,3R,4S,5R,6S)-3,4,5-tribenzoyloxy-6-methoxyoxan-2-yl]methoxymethyl]triazol-1-yl]butoxy]benzoic acid
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| Synonyms |
CHEMBL1822606; BDBM50351998
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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 |
C42H41N3O13
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| Canonical SMILES |
CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CN(N=N2)CCCCOC3=CC(=C(C=C3)O)C(=O)O)OC(=O)C4=CC=CC=C4)OC(=O)C5=CC=CC=C5)OC(=O)C6=CC=CC=C6
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| InChI |
1S/C42H41N3O13/c1-52-42-37(58-41(51)29-17-9-4-10-18-29)36(57-40(50)28-15-7-3-8-16-28)35(56-39(49)27-13-5-2-6-14-27)34(55-42)26-53-25-30-24-45(44-43-30)21-11-12-22-54-31-19-20-33(46)32(23-31)38(47)48/h2-10,13-20,23-24,34-37,42,46H,11-12,21-22,25-26H2,1H3,(H,47,48)/t34-,35-,36+,37-,42+/m1/s1
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| InChIKey |
JOKBXZDVNPKDTC-IQEGRXIQSA-N
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| PubChem Compound ID | ||||
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