Drug Information
| Drug General Information | |||||
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| Drug ID |
DXG2BY
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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-(2-carbamoyl-3-phenyl-propionylamino)-succinamic acid
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| Synonyms |
CHEMBL1160485
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C52H69N9O15S
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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)[C@@H](Cc4ccccc4)C(=O)N
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| InChI |
InChI=1S/C52H69N9O15S/c1-6-8-18-38(57-49(69)40(61-51(71)75-52(3,4)5)26-32-21-23-34(24-22-32)76-77(72,73)74)46(66)55-30-56-47(67)41(27-33-29-54-37-20-14-13-17-35(33)37)60-48(68)39(19-9-7-2)58-50(70)42(28-43(62)63)59-45(65)36(44(53)64)25-31-15-11-10-12-16-31/h10-17,20-24,29,36,38-42,54H,6-9,18-19,25-28,30H2,1-5H3,(H2,53,64)(H,55,66)(H,56,67)(H,57,69)(H,58,70)(H,59,65)(H,60,68)(H,61,71)(H,62,63)(H,72,73,74)/t36-,38-,39-,40-,41-,42-/m0/s1
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| InChIKey |
TXSXJYRAIUVBDO-NLDSVXPCSA-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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