Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BW98QN
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| Binder Name |
(1S,3R,4S,5R)-4-Acetamido-1-[(2S,3S,4S,5R,6S)-2-[(2S,3S,4R,5S,6R)-5-acetamido-6-hydroxy-2-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3-hydroxy-5-[(1S,2R)-1,2,3-trihydroxypropyl]cyclohexane-1-carboxylic acid
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| Synonyms |
CHEMBL3215473
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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 |
C32H54N2O22
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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@]4(C[C@H]([C@@H]([C@@H](C4)O)NC(=O)C)[C@@H]([C@@H](CO)O)O)C(=O)O)O)CO)O)NC(=O)C)O)O)O
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| InChI |
1S/C32H54N2O22/c1-9-19(42)22(45)23(46)29(51-9)55-26-18(34-11(3)39)28(48)52-16(8-37)25(26)54-30-24(47)27(21(44)15(7-36)53-30)56-32(31(49)50)4-12(20(43)14(41)6-35)17(13(40)5-32)33-10(2)38/h9,12-30,35-37,40-48H,4-8H2,1-3H3,(H,33,38)(H,34,39)(H,49,50)/t9-,12+,13+,14+,15-,16-,17-,18-,19+,20-,21+,22+,23-,24-,25+,26+,27-,28+,29-,30-,32-/m0/s1
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| InChIKey |
DIACHMFFHKKXHX-ZLRUHKEQSA-N
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| PubChem Compound ID | ||||
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