Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B6RY4E
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| Binder Name |
(2S)-2-[[2-[[(2S)-2-[[(2S)-4-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-phenylbutanoyl]amino]-3-methylbutanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-(4-phosphonooxyphenyl)propanoyl]amino]-4-oxobutanoyl]amino]-4-methylpentanoyl]amino]acetyl]amino]pentanedioic acid
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| Synonyms |
CHEMBL2371864
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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 |
C46H68N9O16PS
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| Canonical SMILES |
CC(C)C[C@@H](C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC1=CC=C(C=C1)OP(=O)(O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC2=CC=CC=C2)N
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| InChI |
1S/C46H68N9O16PS/c1-25(2)21-33(41(61)49-24-37(57)50-32(46(66)67)17-18-38(58)59)52-44(64)35(23-36(48)56)54-43(63)34(22-28-11-14-29(15-12-28)71-72(68,69)70)53-42(62)31(19-20-73-5)51-45(65)39(26(3)4)55-40(60)30(47)16-13-27-9-7-6-8-10-27/h6-12,14-15,25-26,30-35,39H,13,16-24,47H2,1-5H3,(H2,48,56)(H,49,61)(H,50,57)(H,51,65)(H,52,64)(H,53,62)(H,54,63)(H,55,60)(H,58,59)(H,66,67)(H2,68,69,70)/t30-,31-,32-,33-,34-,35-,39-/m0/s1
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| InChIKey |
BJNZTWZBNUGHPQ-GJWSKJNDSA-N
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| PubChem Compound ID | ||||
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