Drug Information
| Drug General Information | |||||
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| Drug ID |
DXD1KE
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| Drug Name |
(S)-3-[(S)-2-[(S)-2-(Adamantan-2-yloxycarbonylamino)-3-1H-indol-3-yl-propionylamino]-6-(3-o-tolyl-ureido)-hexanoylamino]-N-((S)-1-carbamoyl-2-phenyl-ethyl)-N-methyl-succinamic acid
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| Synonyms |
CHEMBL429932
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| Indication | Discovery agent | Investigative | [1587926] | ||
| Formula |
C50H62N8O9
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| Canonical SMILES |
CN([C@@H](Cc1ccccc1)C(=O)N)C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCCNC(=O)Nc2ccccc2C)NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)OC5C6CC7CC(CC5C7)C6
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| InChI |
InChI=1S/C50H62N8O9/c1-29-12-6-8-16-37(29)56-49(65)52-19-11-10-18-39(46(62)55-41(27-43(59)60)48(64)58(2)42(45(51)61)25-30-13-4-3-5-14-30)54-47(63)40(26-35-28-53-38-17-9-7-15-36(35)38)57-50(66)67-44-33-21-31-20-32(23-33)24-34(44)22-31/h3-9,12-17,28,31-34,39-42,44,53H,10-11,18-27H2,1-2H3,(H2,51,61)(H,54,63)(H,55,62)(H,57,66)(H,59,60)(H2,52,56,65)/t31?,32?,33?,34?,39-,40-,41-,42-,44?/m0/s1
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| InChIKey |
SIFJSUVNYAKESG-FOTWVXDPSA-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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