Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BKU81F
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| Binder Name |
(2R,4S,5R,6R)-6-[(1R,2R)-1,2-Dihydroxy-3-[[2-[4-(4-hydroxyphenyl)phenyl]acetyl]amino]propyl]-4-hydroxy-5-[(2-hydroxyacetyl)amino]-2-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-(4-methoxyphenoxy)oxan-2-yl]methoxy]oxane-2-carboxylic acid
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| Synonyms |
CHEMBL501599; GSC-660; BDBM50274296
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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 |
C38H46N2O17
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| Canonical SMILES |
COC1=CC=C(C=C1)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO[C@@]3(C[C@@H]([C@H]([C@@H](O3)[C@@H]([C@@H](CNC(=O)CC4=CC=C(C=C4)C5=CC=C(C=C5)O)O)O)NC(=O)CO)O)C(=O)O)O)O)O
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| InChI |
1S/C38H46N2O17/c1-53-23-10-12-24(13-11-23)55-36-34(50)33(49)32(48)27(56-36)18-54-38(37(51)52)15-25(43)30(40-29(46)17-41)35(57-38)31(47)26(44)16-39-28(45)14-19-2-4-20(5-3-19)21-6-8-22(42)9-7-21/h2-13,25-27,30-36,41-44,47-50H,14-18H2,1H3,(H,39,45)(H,40,46)(H,51,52)/t25-,26+,27+,30+,31+,32-,33-,34+,35+,36+,38+/m0/s1
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| InChIKey |
OTRZIYCZOYEUAW-ZSGSMGMISA-N
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| PubChem Compound ID | ||||
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