Binder Information
Binder General Information | Top | |||
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Binder ID |
BY8O1E
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Binder Name |
(2S)-5-Amino-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2R)-2-aminopropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]-6-[(2-phenylcyclopropyl)amino]hexanoyl]amino]-5-oxopentanoic acid
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Synonyms |
CHEMBL3402055; BDBM50067587
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C33H54N10O8
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Canonical SMILES |
C[C@@H]([C@@H](C(=O)N[C@@H](CCCCNC1CC1C2=CC=CC=C2)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](C)N)O
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InChI |
1S/C33H54N10O8/c1-18(34)28(46)40-23(12-8-16-39-33(36)37)30(48)43-27(19(2)44)31(49)41-22(29(47)42-24(32(50)51)13-14-26(35)45)11-6-7-15-38-25-17-21(25)20-9-4-3-5-10-20/h3-5,9-10,18-19,21-25,27,38,44H,6-8,11-17,34H2,1-2H3,(H2,35,45)(H,40,46)(H,41,49)(H,42,47)(H,43,48)(H,50,51)(H4,36,37,39)/t18-,19+,21?,22+,23+,24+,25?,27+/m1/s1
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InChIKey |
BOUXWAISSFFUNV-NSQOHAPDSA-N
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PubChem Compound ID |
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