Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BSU02V
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| Binder Name |
[(2S,3R,4R,5R,6R)-2-[3-[4-[3-[(2R,3S,4S,5R,6S)-3,4-Dihydroxy-6-(hydroxymethyl)-5-[(2R,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]sulfanylprop-1-ynyl]phenyl]prop-2-ynylsulfanyl]-3-hydroxy-6-(hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl] acetate
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| Synonyms |
CHEMBL444523; BDBM50272383
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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 |
C38H52O21S2
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| Canonical SMILES |
CC(=O)O[C@@H]1[C@H]([C@@H](O[C@@H]([C@H]1O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)CO)SCC#CC3=CC=C(C=C3)C#CCS[C@@H]4[C@H]([C@@H]([C@H]([C@@H](O4)CO)O[C@@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)CO)O)O)O)O)O)O
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| InChI |
1S/C38H52O21S2/c1-16(43)53-34-31(52)38(57-22(15-42)33(34)59-36-29(50)26(47)24(45)20(13-40)55-36)61-11-3-5-18-8-6-17(7-9-18)4-2-10-60-37-30(51)27(48)32(21(14-41)56-37)58-35-28(49)25(46)23(44)19(12-39)54-35/h6-9,19-42,44-52H,10-15H2,1H3/t19-,20+,21-,22+,23+,24-,25+,26-,27-,28-,29+,30-,31+,32-,33+,34+,35+,36-,37+,38-/m0/s1
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| InChIKey |
RRNMMLATPGLHTL-TTWBQDMCSA-N
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| PubChem Compound ID | ||||
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