Drug Information
| Drug General Information | |||||
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| Drug ID |
DXB2XB
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| Drug Name |
3-[2-[2-tert-Butoxycarbonylamino-3-(1H-indol-3-yl)-propionylamino]-6-(3-1H-indol-3-yl-acryloylamino)-hexanoylamino]-N-(1-carbamoyl-2-phenyl-ethyl)-succinamic acid; hydrate
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| Synonyms |
CHEMBL294304
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C46H54N8O9
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCNC(=O)\\C=C\\c3c[nH]c4ccccc34)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc5ccccc5)C(=O)N
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| InChI |
InChI=1S/C46H54N8O9/c1-46(2,3)63-45(62)54-37(24-30-27-50-34-18-10-8-16-32(30)34)43(60)51-35(19-11-12-22-48-39(55)21-20-29-26-49-33-17-9-7-15-31(29)33)42(59)53-38(25-40(56)57)44(61)52-36(41(47)58)23-28-13-5-4-6-14-28/h4-10,13-18,20-21,26-27,35-38,49-50H,11-12,19,22-25H2,1-3H3,(H2,47,58)(H,48,55)(H,51,60)(H,52,61)(H,53,59)(H,54,62)(H,56,57)/b21-20+/t35-,36-,37-,38-/m0/s1
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| InChIKey |
ZXQXVAABIPFAEA-FVFUGZIGSA-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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