Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BO5HC1
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| Binder Name |
Sodium;(2S,4R,5R,6R)-5-acetamido-2-[(2S,3S,4S,5S,6S)-2-[(2S,3S,4R,5S,6S)-6-[(2R,3S,4S,5S,6S)-2-ethoxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-2-(hydroxymethyl)-5-(naphthalene-2-carbonylamino)-4-[(2S,3S,4S,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate
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| Synonyms |
CHEMBL2368519; BDBM50051836
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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 |
C48H69N2NaO28
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| Canonical SMILES |
CCO[C@H]1[C@H]([C@H]([C@H]([C@@H](O1)CO)O)O[C@H]2[C@H]([C@H]([C@@H]([C@@H](O2)CO)O[C@H]3[C@H]([C@H]([C@H]([C@@H](O3)CO)O)O[C@@]4(C[C@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)[O-])O)O[C@H]5[C@H]([C@H]([C@@H]([C@@H](O5)C)O)O)O)NC(=O)C6=CC7=CC=CC=C7C=C6)O.[Na+]
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| InChI |
1S/C48H70N2O28.Na/c1-4-69-44-35(64)40(31(60)24(14-52)71-44)76-43-28(50-42(66)21-10-9-19-7-5-6-8-20(19)11-21)39(75-45-34(63)33(62)29(58)17(2)70-45)37(26(16-54)73-43)74-46-36(65)41(32(61)25(15-53)72-46)78-48(47(67)68)12-22(56)27(49-18(3)55)38(77-48)30(59)23(57)13-51;/h5-11,17,22-41,43-46,51-54,56-65H,4,12-16H2,1-3H3,(H,49,55)(H,50,66)(H,67,68);/q;+1/p-1/t17-,22+,23+,24-,25-,26-,27+,28-,29+,30+,31-,32-,33-,34-,35-,36-,37+,38+,39+,40-,41-,43-,44+,45-,46-,48-;/m0./s1
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| InChIKey |
ACUSYQYRBVNQMU-BDEBOGSHSA-M
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| PubChem Compound ID | ||||
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