Binder Information
Binder General Information | Top | |||
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Binder ID |
BO0A5M
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Binder Name |
Tyr-Ser-Phe-Lys-Asp-Cys-Pro-Leu-Cys-Arg
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Synonyms |
CHEMBL386860; BDBM50033572
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Binder Type |
Small molecular drug
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Structure |
Download2D MOL
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Formula |
C54H82N14O15S2
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Canonical SMILES |
CC(C)C[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CC3=CC=C(C=C3)O)N
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InChI |
1S/C54H82N14O15S2/c1-29(2)22-36(46(75)66-40(27-84)50(79)61-35(53(82)83)13-8-20-59-54(57)58)64-51(80)42-14-9-21-68(42)52(81)41(28-85)67-48(77)38(25-43(71)72)63-45(74)34(12-6-7-19-55)60-47(76)37(24-30-10-4-3-5-11-30)62-49(78)39(26-69)65-44(73)33(56)23-31-15-17-32(70)18-16-31/h3-5,10-11,15-18,29,33-42,69-70,84-85H,6-9,12-14,19-28,55-56H2,1-2H3,(H,60,76)(H,61,79)(H,62,78)(H,63,74)(H,64,80)(H,65,73)(H,66,75)(H,67,77)(H,71,72)(H,82,83)(H4,57,58,59)/t33-,34-,35-,36-,37-,38-,39-,40-,41-,42-/m0/s1
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InChIKey |
OGZUAEPKQICSRT-NUDUWCFGSA-N
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PubChem Compound ID |
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