Binder Information
| Binder General Information | Top | |||
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| Binder ID |
B5BT3G
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| Binder Name |
(2S)-2-[[2-[[(2S)-2-[[(2S)-4-Amino-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-amino-3-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 |
CHEMBL412918; BDBM50162447
Click to Show/Hide
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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](C(C)C2=CC=CC=C2)N
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| InChI |
1S/C46H68N9O16PS/c1-24(2)20-32(40(60)49-23-36(57)50-31(46(66)67)16-17-37(58)59)52-43(63)34(22-35(47)56)54-42(62)33(21-27-12-14-29(15-13-27)71-72(68,69)70)53-41(61)30(18-19-73-6)51-45(65)39(25(3)4)55-44(64)38(48)26(5)28-10-8-7-9-11-28/h7-15,24-26,30-34,38-39H,16-23,48H2,1-6H3,(H2,47,56)(H,49,60)(H,50,57)(H,51,65)(H,52,63)(H,53,61)(H,54,62)(H,55,64)(H,58,59)(H,66,67)(H2,68,69,70)/t26?,30-,31+,32+,33+,34+,38-,39+/m1/s1
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| InChIKey |
APYXVQQEUSUKFU-HFFSORKGSA-N
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| PubChem Compound ID | ||||
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