Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
DXTJ6J
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| Drug Name |
3-{2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-6-[(5-chloro-1H-indole-2-carbonyl)-amino]-hexanoylamino}-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid; hydrate
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| Synonyms |
CHEMBL418500
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C44H51ClN8O9
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)c3cc4cc(Cl)ccc4[nH]3)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc5ccccc5)C(=O)N
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| InChI |
InChI=1S/C44H51ClN8O9/c1-44(2,3)62-43(61)53-35(22-27-24-48-31-14-8-7-13-29(27)31)41(59)50-32(15-9-10-18-47-39(57)34-21-26-20-28(45)16-17-30(26)49-34)40(58)52-36(23-37(54)55)42(60)51-33(38(46)56)19-25-11-5-4-6-12-25/h4-8,11-14,16-17,20-21,24,32-33,35-36,48-49H,9-10,15,18-19,22-23H2,1-3H3,(H2,46,56)(H,47,57)(H,50,59)(H,51,60)(H,52,58)(H,53,61)(H,54,55)/t32-,33-,35-,36-/m0/s1
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| InChIKey |
FAGRIRVULCVADH-IZVAWUQISA-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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