Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BI87NQ
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| Binder Name |
2-[3-[5-[[4-[[3-[3-(Carboxymethyl)phenyl]-4-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]methyl]phenyl]methyl]-2-[(2R,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]phenyl]acetic acid
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| Synonyms |
CHEMBL2303888; BDBM50422295
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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 |
C48H50O16
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| Canonical SMILES |
C1=CC(=CC(=C1)C2=C(C=CC(=C2)CC3=CC=C(C=C3)CC4=CC(=C(C=C4)O[C@@H]5[C@H]([C@@H]([C@@H]([C@H](O5)CO)O)O)O)C6=CC=CC(=C6)CC(=O)O)O[C@@H]7[C@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O)CC(=O)O
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| InChI |
1S/C48H50O16/c49-23-37-41(55)43(57)45(59)47(63-37)61-35-13-11-29(19-33(35)31-5-1-3-27(17-31)21-39(51)52)15-25-7-9-26(10-8-25)16-30-12-14-36(62-48-46(60)44(58)42(56)38(24-50)64-48)34(20-30)32-6-2-4-28(18-32)22-40(53)54/h1-14,17-20,37-38,41-50,55-60H,15-16,21-24H2,(H,51,52)(H,53,54)/t37-,38-,41-,42-,43-,44-,45+,46+,47+,48+/m1/s1
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| InChIKey |
QTIHCZRABNPCAO-GHVPGAINSA-N
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| PubChem Compound ID | ||||
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