Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
DXFI9W
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| Drug Name |
N-{1-[1-[({2-[2-tert-Butoxycarbonylamino-3-(4-sulfooxy-phenyl)-propionylamino]-hexanoylamino}-methyl)-carbamoyl]-2-(1H-indol-3-yl)-ethylcarbamoyl]-pentyl}-3-(3-phenyl-propionylamino)-succinamic acid
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| Synonyms |
CHEMBL1160499
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C51H68N8O14S
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| Canonical SMILES |
CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(=O)(=O)O)cc1)NC(=O)OC(C)(C)C)C(=O)NCNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CCCC)NC(=O)[C@H](CC(=O)O)NC(=O)CCc4ccccc4
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| InChI |
InChI=1S/C51H68N8O14S/c1-6-8-18-38(56-48(66)40(59-50(68)72-51(3,4)5)27-33-21-24-35(25-22-33)73-74(69,70)71)45(63)53-31-54-46(64)41(28-34-30-52-37-20-14-13-17-36(34)37)58-47(65)39(19-9-7-2)57-49(67)42(29-44(61)62)55-43(60)26-23-32-15-11-10-12-16-32/h10-17,20-22,24-25,30,38-42,52H,6-9,18-19,23,26-29,31H2,1-5H3,(H,53,63)(H,54,64)(H,55,60)(H,56,66)(H,57,67)(H,58,65)(H,59,68)(H,61,62)(H,69,70,71)/t38-,39-,40-,41-,42-/m0/s1
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| InChIKey |
QHXBSJRCFQZXTO-FDXDWZSASA-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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