Binder Information
Binder General Information | Top | |||
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Binder ID |
B5Q4WX
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Binder Name |
Glu-Cys-Arg-Ser-Thr-Ser-Tyr-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu
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Synonyms |
CHEMBL2371380; BDBM50013364
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C65H105N19O25S
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Canonical SMILES |
C[C@H]([C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)N)O
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InChI |
1S/C65H105N19O25S/c1-27(2)19-40(64(108)109)78-57(101)39(22-47(93)94)76-56(100)38(21-44(67)89)77-61(105)48(28(3)4)83-62(106)49(29(5)6)82-52(96)31(8)72-45(90)23-71-51(95)30(7)73-55(99)37(20-33-12-14-34(88)15-13-33)75-58(102)41(24-85)80-63(107)50(32(9)87)84-59(103)42(25-86)79-54(98)36(11-10-18-70-65(68)69)74-60(104)43(26-110)81-53(97)35(66)16-17-46(91)92/h12-15,27-32,35-43,48-50,85-88,110H,10-11,16-26,66H2,1-9H3,(H2,67,89)(H,71,95)(H,72,90)(H,73,99)(H,74,104)(H,75,102)(H,76,100)(H,77,105)(H,78,101)(H,79,98)(H,80,107)(H,81,97)(H,82,96)(H,83,106)(H,84,103)(H,91,92)(H,93,94)(H,108,109)(H4,68,69,70)/t30-,31-,32+,35-,36-,37-,38-,39-,40-,41-,42-,43-,48-,49-,50-/m0/s1
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InChIKey |
HPKYGVPBDLOIBT-FLONGNAISA-N
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PubChem Compound ID |
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