Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BOLD04
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| Binder Name |
(4S,7S,13S)-13-[[(2R,3R)-2-Amino-3-(4-hydroxyphenyl)butanoyl]amino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triazacyclotetradecane-4-carboxylic acid
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| Synonyms |
CHEMBL80626; BDBM50000809
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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 |
C31H41N5O7S2
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| Canonical SMILES |
C[C@H](C1=CC=C(C=C1)O)[C@H](C(=O)N[C@H]2C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(SSC2(C)C)(C)C)C(=O)O)CC3=CC=CC=C3)N
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| InChI |
1S/C31H41N5O7S2/c1-17(19-11-13-20(37)14-12-19)23(32)27(40)35-24-28(41)33-16-22(38)34-21(15-18-9-7-6-8-10-18)26(39)36-25(29(42)43)31(4,5)45-44-30(24,2)3/h6-14,17,21,23-25,37H,15-16,32H2,1-5H3,(H,33,41)(H,34,38)(H,35,40)(H,36,39)(H,42,43)/t17-,21+,23-,24+,25+/m1/s1
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| InChIKey |
ABAHQIMHTWGRPU-ODJGSJHLSA-N
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| PubChem Compound ID | ||||
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