Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BRS6Y2
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| Binder Name |
3-[((S)-2-{(3S,4S)-4-[(R)-2-((S)-2-Acetylamino-4-methyl-pentanoylamino)-propionylamino]-3-hydroxy-6-methyl-heptanoylamino}-3-methyl-butyrylamino)-methyl]-benzoic acid
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| Synonyms |
CHEMBL334591; BDBM50136327
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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 |
C32H51N5O8
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| Canonical SMILES |
C[C@H](C(=O)N[C@@H](CC(C)C)[C@H](CC(=O)N[C@@H](C(C)C)C(=O)NCC1=CC(=CC=C1)C(=O)O)O)NC(=O)[C@H](CC(C)C)NC(=O)C
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| InChI |
1S/C32H51N5O8/c1-17(2)12-24(36-29(41)20(7)34-30(42)25(13-18(3)4)35-21(8)38)26(39)15-27(40)37-28(19(5)6)31(43)33-16-22-10-9-11-23(14-22)32(44)45/h9-11,14,17-20,24-26,28,39H,12-13,15-16H2,1-8H3,(H,33,43)(H,34,42)(H,35,38)(H,36,41)(H,37,40)(H,44,45)/t20-,24+,25+,26+,28+/m1/s1
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| InChIKey |
XUFSYXVSQNGXSZ-QSIITTNHSA-N
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| PubChem Compound ID | ||||
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