Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
B3A8DG
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| Binder Name |
N-Ac-Trp(CHO)-Pro[CH2O]Phe-His-Sta-Ile-Phe-OCH3
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| Synonyms |
CHEMBL413362; BDBM50022906
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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 |
C58H76N10O11
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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)C)N)O
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| InChI |
1S/C58H76N10O11/c1-6-37(3)53(56(75)65-48(58(77)78-5)25-39-16-9-7-10-17-39)66-52(72)29-50(71)45(59)24-36(2)30-61-54(73)46(28-42-31-60-34-62-42)64-55(74)51(26-40-18-11-8-12-19-40)79-33-43-20-15-23-68(43)57(76)47(63-38(4)70)27-41-32-67(35-69)49-22-14-13-21-44(41)49/h7-14,16-19,21-22,31-32,34-37,43,45-48,50-51,53,71H,6,15,20,23-30,33,59H2,1-5H3,(H,60,62)(H,61,73)(H,63,70)(H,64,74)(H,65,75)(H,66,72)/t36?,37-,43-,45?,46-,47-,48-,50?,51-,53-/m0/s1
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| InChIKey |
WQJRFPKQXNJRAU-ZBIBQWPESA-N
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| PubChem Compound ID | ||||
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