Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
DX0AVX
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| Drug Name |
Boc-Tyr(So3-)-Nle-Gly-Trp-psi(CH2NH)-Nle-Asp-Phe-NH2
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| Synonyms |
CHEMBL1159910
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C52H71N9O14S
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| Canonical SMILES |
CCCC[C@H](NC[C@H](Cc1c[nH]c2ccccc12)NC(=O)CNC(=O)[C@H](CCCC)NC(=O)[C@H](Cc3ccc(OS(=O)(=O)O)cc3)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N
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| InChI |
InChI=1S/C52H71N9O14S/c1-6-8-18-39(48(67)60-43(28-45(63)64)50(69)59-41(46(53)65)25-32-15-11-10-12-16-32)55-30-35(27-34-29-54-38-20-14-13-17-37(34)38)57-44(62)31-56-47(66)40(19-9-7-2)58-49(68)42(61-51(70)74-52(3,4)5)26-33-21-23-36(24-22-33)75-76(71,72)73/h10-17,20-24,29,35,39-43,54-55H,6-9,18-19,25-28,30-31H2,1-5H3,(H2,53,65)(H,56,66)(H,57,62)(H,58,68)(H,59,69)(H,60,67)(H,61,70)(H,63,64)(H,71,72,73)/t35-,39-,40-,41-,42-,43-/m0/s1
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| InChIKey |
YYUMVSJDMJRIKE-KKNXFESQSA-N
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| Target and Pathway | |||||
| Target(s) | Gastrin/cholecystokinin type B receptor | Target Info | [1587926] | ||
| Cholecystokinin receptor type A | Target Info | [1587926] | |||
| PANTHER Pathway | CCKR signaling map ST | ||||
| PathWhiz Pathway | Gastric Acid Production | ||||
| References | |||||
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