Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
B3S5UM
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| Binder Name |
Boc-Trp(CHO)-Pro[CH2O]Phe-His-Sta-Ile-Phe-OCH3
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| Synonyms |
CHEMBL437229; BDBM50022901
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|
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| Binder Type |
Small molecular drug
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| Structure |
 |
Download2D MOL
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| Formula |
C61H82N10O12
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| Canonical SMILES |
CC[C@H](C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC)NC(=O)CC(C(CC(C)CNC(=O)[C@H](CC2=CN=CN2)NC(=O)[C@H](CC3=CC=CC=C3)OC[C@@H]4CCCN4C(=O)[C@H](CC5=CN(C6=CC=CC=C65)C=O)NC(=O)OC(C)(C)C)N)O
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| InChI |
1S/C61H82N10O12/c1-8-39(3)54(57(77)67-49(59(79)81-7)27-40-18-11-9-12-19-40)69-53(74)31-51(73)46(62)26-38(2)32-64-55(75)47(30-43-33-63-36-65-43)66-56(76)52(28-41-20-13-10-14-21-41)82-35-44-22-17-25-71(44)58(78)48(68-60(80)83-61(4,5)6)29-42-34-70(37-72)50-24-16-15-23-45(42)50/h9-16,18-21,23-24,33-34,36-39,44,46-49,51-52,54,73H,8,17,22,25-32,35,62H2,1-7H3,(H,63,65)(H,64,75)(H,66,76)(H,67,77)(H,68,80)(H,69,74)/t38?,39-,44-,46?,47-,48-,49-,51?,52-,54-/m0/s1
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| InChIKey |
AFCJNXJVXCTGJT-WXTPBQLRSA-N
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| PubChem Compound ID | ||||
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