Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B2UG6E
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| Binder Name |
(4S)-4-[[(2S)-2-[[(2R)-1-[4-[[(2S)-2-[[(2S)-2-Acetamido-3-methylbutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxy-6-methylheptanoyl]pyrrolidine-2-carbonyl]amino]propanoyl]amino]-5-[[(1S)-1-carboxy-2-phenylethyl]amino]-5-oxopentanoic acid
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| Synonyms |
CHEMBL420418; BDBM50108546
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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 |
C42H65N7O12S
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| Canonical SMILES |
C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H]2CCCN2C(=O)CC(C(CC(C)C)NC(=O)[C@H](CCSC)NC(=O)[C@H](C(C)C)NC(=O)C)O
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| InChI |
1S/C42H65N7O12S/c1-23(2)20-30(47-39(57)29(17-19-62-7)46-41(59)36(24(3)4)44-26(6)50)33(51)22-34(52)49-18-11-14-32(49)40(58)43-25(5)37(55)45-28(15-16-35(53)54)38(56)48-31(42(60)61)21-27-12-9-8-10-13-27/h8-10,12-13,23-25,28-33,36,51H,11,14-22H2,1-7H3,(H,43,58)(H,44,50)(H,45,55)(H,46,59)(H,47,57)(H,48,56)(H,53,54)(H,60,61)/t25-,28-,29-,30?,31-,32+,33?,36-/m0/s1
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| InChIKey |
GIKNDGTXDZTXKV-ULFJMECDSA-N
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| PubChem Compound ID | ||||
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