Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BDRG29
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| Binder Name |
(2S,3S,4R,5R,6R)-3-[(2S,3R,4R,5S,6R)-3-Acetamido-4-[(2R,3R,4R,5S,6S)-5-[(2S,3R,4R,5S,6R)-3-acetamido-4-[(2R,3R,4R,5S,6S)-5-[(2S,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6-carboxy-3,4-dihydroxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5,6-trihydroxyoxane-2-carboxylic acid
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| Synonyms |
CHEMBL3237620; BDBM50008909
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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 |
C42H65N3O34
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| Canonical SMILES |
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2C(=O)O)O[C@@H]3[C@H]([C@@H](O[C@@H]([C@H]3O)CO)O[C@H]4[C@@H]([C@H]([C@@H](O[C@@H]4C(=O)O)O[C@@H]5[C@H]([C@@H](O[C@@H]([C@H]5O)CO)O[C@H]6[C@@H]([C@H]([C@@H](O[C@@H]6C(=O)O)O)O)O)NC(=O)C)O)O)NC(=O)C)O)O)CO)O)O
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| InChI |
1S/C42H65N3O34/c1-7(49)43-13-19(55)16(52)10(4-46)69-38(13)75-29-21(57)24(60)41(78-32(29)35(64)65)74-27-15(45-9(3)51)40(71-12(6-48)18(27)54)77-30-22(58)25(61)42(79-33(30)36(66)67)73-26-14(44-8(2)50)39(70-11(5-47)17(26)53)76-28-20(56)23(59)37(68)72-31(28)34(62)63/h10-33,37-42,46-48,52-61,68H,4-6H2,1-3H3,(H,43,49)(H,44,50)(H,45,51)(H,62,63)(H,64,65)(H,66,67)/t10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28+,29+,30+,31+,32+,33+,37-,38+,39+,40+,41-,42-/m1/s1
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| InChIKey |
XPUFUQLOOZFGID-GFAJNXTCSA-N
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| PubChem Compound ID | ||||
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