TIP39-(3-39) (human/bovine)   Click here for help

GtoPdb Ligand ID: 1816

Synonyms: human/bovine tuberoinfundibular peptide 3-39
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES NCCCCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1CCCC1C(=O)O)C)CC(=O)O)CC(C)C)C(C)C)CC(C)C)CC(C)C)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(N)C)CC(C)C)C)CC(=O)O)CC(=O)O)C)C)Cc1ccccc1)CCCN=C(N)N)CCC(=O)O)CCCN=C(N)N)C)CCCN=C(N)N)CC(C)C)CC(C)C)C)C)CC(C)C)CCC(=O)O)CCCN=C(N)N)CCCN=C(N)N)Cc1nc[nH]c1)CC(C)C)CC(=O)N)CO)Cc1ccc(cc1)O)CCSC)Cc1nc[nH]c1
Isomeric SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)C(C)C
InChI InChI=1S/C193H309N59O51S/c1-92(2)69-126(233-152(266)101(19)195)168(282)222-107(25)158(272)236-142(85-150(264)265)183(297)248-140(83-148(260)261)170(284)221-103(21)154(268)218-105(23)157(271)235-134(77-109-41-29-28-30-42-109)177(291)229-121(49-38-65-212-192(203)204)161(275)230-123(56-58-146(256)257)165(279)225-118(46-35-62-209-189(197)198)159(273)219-106(24)155(269)224-119(47-36-63-210-190(199)200)163(277)238-129(72-95(7)8)173(287)239-127(70-93(3)4)169(283)220-102(20)153(267)217-104(22)156(270)234-128(71-94(5)6)172(286)231-124(57-59-147(258)259)166(280)227-120(48-37-64-211-191(201)202)160(274)226-122(50-39-66-213-193(205)206)164(278)244-138(81-113-88-208-91-216-113)181(295)243-136(79-111-86-214-116-44-32-31-43-115(111)116)179(293)240-131(74-97(11)12)175(289)246-139(82-145(196)255)182(296)250-143(89-253)185(299)242-135(78-110-52-54-114(254)55-53-110)178(292)232-125(60-68-304-27)167(281)245-137(80-112-87-207-90-215-112)180(294)228-117(45-33-34-61-194)162(276)237-130(73-96(9)10)174(288)241-133(76-99(15)16)184(298)251-151(100(17)18)186(300)249-132(75-98(13)14)176(290)247-141(84-149(262)263)171(285)223-108(26)187(301)252-67-40-51-144(252)188(302)303/h28-32,41-44,52-55,86-88,90-108,117-144,151,214,253-254H,33-40,45-51,56-85,89,194-195H2,1-27H3,(H2,196,255)(H,207,215)(H,208,216)(H,217,267)(H,218,268)(H,219,273)(H,220,283)(H,221,284)(H,222,282)(H,223,285)(H,224,269)(H,225,279)(H,226,274)(H,227,280)(H,228,294)(H,229,291)(H,230,275)(H,231,286)(H,232,292)(H,233,266)(H,234,270)(H,235,271)(H,236,272)(H,237,276)(H,238,277)(H,239,287)(H,240,293)(H,241,288)(H,242,299)(H,243,295)(H,244,278)(H,245,281)(H,246,289)(H,247,290)(H,248,297)(H,249,300)(H,250,296)(H,251,298)(H,256,257)(H,258,259)(H,260,261)(H,262,263)(H,264,265)(H,302,303)(H4,197,198,209)(H4,199,200,210)(H4,201,202,211)(H4,203,204,212)(H4,205,206,213)/t101-,102-,103-,104-,105-,106-,107-,108-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,140-,141-,142-,143-,144-,151-/m0/s1
InChI Key LRMJKUCVFLZDRO-WFFQVJADSA-N
Classification Click here for help
Compound class Peptide or derivative
Synonyms Click here for help
human/bovine tuberoinfundibular peptide 3-39
Database Links Click here for help
GtoPdb PubChem SID 135652605
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Search UniChem for chemicals with the same backbone LRMJKUCVFLZDRO