Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BS7C3Q
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| Binder Name |
13-[2-Amino-3-(4-hydroxy-3-nitro-phenyl)-propionylamino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triaza-cyclotetradecane-4-carboxylic acid
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| Synonyms |
CHEMBL412569; BDBM50000804
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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 |
C30H38N6O9S2
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| Canonical SMILES |
CC1([C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(SS1)(C)C)C(=O)O)CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC(=C(C=C3)O)[N+](=O)[O-])N)C
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| InChI |
1S/C30H38N6O9S2/c1-29(2)23(34-25(39)18(31)12-17-10-11-21(37)20(14-17)36(44)45)27(41)32-15-22(38)33-19(13-16-8-6-5-7-9-16)26(40)35-24(28(42)43)30(3,4)47-46-29/h5-11,14,18-19,23-24,37H,12-13,15,31H2,1-4H3,(H,32,41)(H,33,38)(H,34,39)(H,35,40)(H,42,43)/t18-,19-,23-,24-/m0/s1
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| InChIKey |
OJUQGPYQUAXREA-WJNSRDFLSA-N
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| PubChem Compound ID | ||||
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