SHR-2042 (sodium salt)
A GLP-1R agonist
| Catalog Number | 42637 |
| Molecular Formula | C205H314N48O63• XNa |
| Purity | ≥95% |
| Inchi | InChI=1S/C205H314N48O63.Na/c1-20-22-23-24-25-26-27-28-29-30-31-32-39-64-152(263)223-134(202(314)315)58-43-45-80-211-174(286)142(100-254)239-193(305)149-61-48-83-251(149)200(312)151-63-50-85-253(151)201(313)150-62-49-84-252(150)199(311)115(15)219-154(265)97-217-175(287)143(101-255)237-190(302)145(103-257)240-192(304)148-60-47-82-250(148)156(267)99-214-153(264)96-215-172(284)127(59-46-81-212-204(208)209)229-194(306)163(109(7)8)245-184(296)136(87-108(5)6)232-183(295)140(91-121-94-213-126-56-41-40-55-124(121)126)230-170(282)114(14)222-196(308)165(111(11)21-2)247-185(297)138(88-118-51-35-33-36-52-118)233-180(292)133(73-78-161(276)277)226-177(289)128(57-42-44-79-206)224-169(281)113(13)220-168(280)112(12)221-176(288)130(70-75-158(270)271)225-178(290)131(71-76-159(272)273)227-179(291)132(72-77-160(274)275)228-181(293)135(86-107(3)4)231-182(294)137(90-120-65-67-123(262)68-66-120)234-188(300)144(102-256)238-191(303)147(105-259)241-195(307)164(110(9)10)246-187(299)141(93-162(278)279)235-189(301)146(104-258)242-198(310)167(117(17)261)248-186(298)139(89-119-53-37-34-38-54-119)236-197(309)166(116(16)260)244-155(266)98-216-173(285)129(69-74-157(268)269)243-203(316)205(18,19)249-171(283)125(207)92-122-95-210-106-218-122;/h33-38,40-41,51-56,65-68,94-95,106-117,125,127-151,163-167,213,254-262H,20-32,39,42-50,57-64,69-93,96-105,206-207H2,1-19H3,(H,210,218)(H,211,286)(H,214,264)(H,215,284)(H,216,285)(H,217,287)(H,219,265)(H,220,280)(H,221,288)(H,222,308)(H,223,263)(H,224,281)(H,225,290)(H,226,289)(H,227,291)(H,228,293)(H,229,306)(H,230,282)(H,231,294)(H,232,295)(H,233,292)(H,234,300)(H,235,301)(H,236,309)(H,237,302)(H,238,303)(H,239,305)(H,240,304)(H,241,307)(H,242,310)(H,243,316)(H,244,266)(H,245,296)(H,246,299)(H,247,297)(H,248,298)(H,249,283)(H,268,269)(H,270,271)(H,272,273)(H,274,275)(H,276,277)(H,278,279)(H,314,315)(H4,208,209,212);/t111-,112-,113-,114-,115-,116+,117+,125-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,145-,146-,147-,148- |
| Inchi Key | BUKJJODAEIXATQ-PSRLKNSKSA-N |
| SMILES | O=C(O)[C@H](CCCCNC([C@H](CO)NC([C@H]1N(C([C@H]2N(C([C@H]3N(C([C@H](C)NC(CNC([C@H](CO)NC([C@H](CO)NC([C@H]4N(C(CNC(CNC([C@H](CCCNC(N)=N)NC([C@H](C(C)C)NC([C@H](CC(C)C)NC([C@H](CC5=CNC6=C5C=CC=C6)NC([C@H](C)NC([C@H]([C@@H](C)CC)NC([C@H](CC7=CC=CC=C7)NC([C@H](CCC(O)=O)NC([C@H](CCCCN)NC([C@H](C)NC([C@H](C)NC([C@H](CCC(O)=O)NC([C@H](CCC(O)=O)NC([C@H](CCC(O)=O)NC([C@H](CC(C)C)NC([C@H](CC8=CC=C(O)C=C8)NC([C@H](CO)NC([C@H](CO)NC([C@H](C(C)C)NC([C@H](CC(O)=O)NC([C@H](CO)NC([C@H]([C@H](O)C)NC([C@H](CC9=CC=CC=C9)NC([C@H]([C@H](O)C)NC(CNC([C@H](CCC(O)=O)NC(C(C)(C)NC([C@H](CC%10=CNC=N%10)N)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CCC4)=O)=O)=O)=O)=O)CCC3)=O)CCC2)=O)CCC1)=O)=O)NC(CCCCCCCCCCCCCCC)=O.[Na] |
| Size | 5 mg |
| Supplier Page | https://www.caymanchem.com/product/42637 |