Binder Information
Binder General Information | Top | |||
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Binder ID |
BAB13W
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Binder Name |
Cyclo[Ac-Cys-Ile-Tyr-Lys-Phe]-Tyr
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Synonyms |
CHEMBL378962; BDBM50187724
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C46H60N8O11S
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Canonical SMILES |
CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC2=CC=C(C=C2)NC(=O)CCC(=O)N[C@H](C(=O)N1)CS)C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O)CCCCN)CC4=CC=C(C=C4)O
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InChI |
1S/C46H60N8O11S/c1-3-26(2)40-45(63)52-35(23-28-9-15-31(55)16-10-28)42(60)50-33(6-4-5-21-47)41(59)51-34(43(61)53-36(46(64)65)24-29-11-17-32(56)18-12-29)22-27-7-13-30(14-8-27)48-38(57)19-20-39(58)49-37(25-66)44(62)54-40/h7-18,26,33-37,40,55-56,66H,3-6,19-25,47H2,1-2H3,(H,48,57)(H,49,58)(H,50,60)(H,51,59)(H,52,63)(H,53,61)(H,54,62)(H,64,65)/t26-,33-,34-,35-,36-,37-,40-/m0/s1
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InChIKey |
DTVDTZKAHTTXEL-NNQXNFOKSA-N
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PubChem Compound ID |
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