Binder Information
| Binder General Information | Top | |||
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| Binder ID |
BP61CA
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| Binder Name |
(4S)-4-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-azidohexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-carboxypropanoyl]amino]-4-carboxybutanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-5-[[(2S)-1-amino-1-oxopent-4-yn-2-yl]amino]-5-oxopentanoic acid
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| Synonyms |
CHEMBL2372116
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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 |
C45H64N12O15
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC#C)C(=O)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](CCCCN)N=[N+]=[N-]
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| InChI |
1S/C45H64N12O15/c1-4-8-27(38(47)65)49-39(66)28(15-17-35(59)60)50-41(68)31(21-24(2)3)54-44(71)34-10-7-20-57(34)45(72)30(16-18-36(61)62)51-43(70)33(23-37(63)64)53-42(69)32(22-25-11-13-26(58)14-12-25)52-40(67)29(55-56-48)9-5-6-19-46/h1,11-14,24,27-34,58H,5-10,15-23,46H2,2-3H3,(H2,47,65)(H,49,66)(H,50,68)(H,51,70)(H,52,67)(H,53,69)(H,54,71)(H,59,60)(H,61,62)(H,63,64)/t27-,28-,29-,30-,31-,32-,33-,34-/m0/s1
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| InChIKey |
MJKPTPGWNBPSOY-LGYYRGKSSA-N
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| PubChem Compound ID | ||||
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