Binder Information
Binder General Information | Top | |||
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Binder ID |
BAL9K1
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Binder Name |
[(5S)-5-[[(2S)-2-[[(2S)-2-[[(2S)-2-Acetamido-3-phenylpropanoyl]amino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-6-[[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]amino]-6-oxohexyl]-trimethylazanium
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Synonyms |
CHEMBL3234145; 4mn3; BDBM50009463
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C35H52N7O8+
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Canonical SMILES |
C[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCC[N+](C)(C)C)C(=O)N[C@@H](CO)C(=O)N)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)C
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InChI |
1S/C35H51N7O8/c1-22(37-34(49)28(38-23(2)44)19-24-11-7-6-8-12-24)32(47)40-29(20-25-14-16-26(45)17-15-25)35(50)39-27(13-9-10-18-42(3,4)5)33(48)41-30(21-43)31(36)46/h6-8,11-12,14-17,22,27-30,43H,9-10,13,18-21H2,1-5H3,(H7-,36,37,38,39,40,41,44,45,46,47,48,49,50)/p+1/t22-,27-,28-,29-,30-/m0/s1
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InChIKey |
CMAVMDKQDSBJEX-NELKFLMZSA-O
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PubChem Compound ID |
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