Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B12MWQ
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| Binder Name |
3-[3-[4-[[(2R,3R,4S,5R,6S)-3,4,5-Tribenzoyloxy-6-methoxyoxan-2-yl]methoxymethyl]triazol-1-yl]propoxy]benzoic acid
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| Synonyms |
CHEMBL1822602; BDBM50351994
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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 |
C41H39N3O12
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| Canonical SMILES |
CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COCC2=CN(N=N2)CCCOC3=CC=CC(=C3)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/C41H39N3O12/c1-50-41-36(56-40(49)29-17-9-4-10-18-29)35(55-39(48)28-15-7-3-8-16-28)34(54-38(47)27-13-5-2-6-14-27)33(53-41)26-51-25-31-24-44(43-42-31)21-12-22-52-32-20-11-19-30(23-32)37(45)46/h2-11,13-20,23-24,33-36,41H,12,21-22,25-26H2,1H3,(H,45,46)/t33-,34-,35+,36-,41+/m1/s1
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| InChIKey |
QQCDFXCYMYPMAM-WIESDFACSA-N
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| PubChem Compound ID | ||||
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