Binder Information
Binder General Information | Top | |||
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Binder ID |
BJ8IQ4
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Binder Name |
4-[4-[5-[3-[4-[4-(2,2-Dimethylpropanoyloxymethoxycarbonyl)-3-methoxy-2,5,6-trimethylphenoxy]carbonyl-3-methoxy-2,5,6-trimethylphenoxy]carbonyl-4-methoxyphenyl]sulfanyl-2-methoxybenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoyl]oxy-2-methoxy-3,5,6-trimethylbenzoic acid
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Synonyms |
CHEMBL406947; BDBM50055421
Click to Show/Hide
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C66H72O20S
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Canonical SMILES |
CC1=C(C(=C(C(=C1C(=O)O)OC)C)OC(=O)C2=C(C(=C(C(=C2C)C)OC(=O)C3=C(C=CC(=C3)SC4=CC(=C(C=C4)OC)C(=O)OC5=C(C(=C(C(=C5C)C)C(=O)OC6=C(C(=C(C(=C6C)C)C(=O)OCOC(=O)C(C)(C)C)OC)C)OC)C)OC)C)OC)C
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InChI |
1S/C66H72O20S/c1-29-33(5)53(37(9)55(77-18)47(29)59(67)68)85-63(72)49-31(3)35(7)51(38(10)57(49)79-20)83-60(69)43-26-41(22-24-45(43)75-16)87-42-23-25-46(76-17)44(27-42)61(70)84-52-36(8)32(4)50(58(80-21)39(52)11)64(73)86-54-34(6)30(2)48(56(78-19)40(54)12)62(71)81-28-82-65(74)66(13,14)15/h22-27H,28H2,1-21H3,(H,67,68)
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InChIKey |
WHGXBJCAKGSGCO-UHFFFAOYSA-N
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PubChem Compound ID |
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