TIP39-(7-39) (mouse)   Click here for help

GtoPdb Ligand ID: 1828

Synonyms: mouse tuberoinfundibular peptide 7-39
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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)CC(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(CC(=O)O)N)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)CCCN=C(N)N)CC(C)C)CC(=O)O)CO)Cc1ccc(cc1)O)CCSC)CCC(=O)N
Isomeric SMILES CSCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCN=C(N)N)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](N)CC(=O)O)C(=O)N[C@@H](CCC(N)=O)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](CC(C)C)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
InChI InChI=1S/C177H290N54O47S/c1-86(2)70-118(221-159(265)120(72-88(5)6)220-150(256)109(44-32-63-194-173(183)184)206-141(247)98(21)203-145(251)108(43-31-62-193-172(181)182)208-153(259)115(55-58-134(235)236)214-148(254)112(47-35-66-197-176(189)190)212-165(271)126(78-100-38-25-24-26-39-100)218-143(249)97(20)200-139(245)94(17)202-144(250)105(179)81-136(239)240)156(262)204-95(18)140(246)201-96(19)142(248)217-119(71-87(3)4)158(264)215-116(56-59-135(237)238)154(260)211-111(46-34-65-196-175(187)188)147(253)209-110(45-33-64-195-174(185)186)146(252)210-113(48-36-67-198-177(191)192)151(257)227-128(80-102-84-199-106-41-28-27-40-104(102)106)167(273)225-125(77-93(15)16)164(270)229-130(83-138(243)244)168(274)230-131(85-232)169(275)226-127(79-101-50-52-103(233)53-51-101)166(272)216-117(60-69-279-23)155(261)213-114(54-57-133(180)234)152(258)207-107(42-29-30-61-178)149(255)219-121(73-89(7)8)160(266)222-122(74-90(9)10)161(267)223-123(75-91(11)12)162(268)224-124(76-92(13)14)163(269)228-129(82-137(241)242)157(263)205-99(22)170(276)231-68-37-49-132(231)171(277)278/h24-28,38-41,50-53,84,86-99,105,107-132,199,232-233H,29-37,42-49,54-83,85,178-179H2,1-23H3,(H2,180,234)(H,200,245)(H,201,246)(H,202,250)(H,203,251)(H,204,262)(H,205,263)(H,206,247)(H,207,258)(H,208,259)(H,209,253)(H,210,252)(H,211,260)(H,212,271)(H,213,261)(H,214,254)(H,215,264)(H,216,272)(H,217,248)(H,218,249)(H,219,255)(H,220,256)(H,221,265)(H,222,266)(H,223,267)(H,224,268)(H,225,273)(H,226,275)(H,227,257)(H,228,269)(H,229,270)(H,230,274)(H,235,236)(H,237,238)(H,239,240)(H,241,242)(H,243,244)(H,277,278)(H4,181,182,193)(H4,183,184,194)(H4,185,186,195)(H4,187,188,196)(H4,189,190,197)(H4,191,192,198)/t94-,95-,96-,97-,98-,99-,105-,107-,108-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-/m0/s1
InChI Key VDGRLJCTLFDSRL-ZBGVNHJGSA-N
Classification Click here for help
Compound class Peptide or derivative
Synonyms Click here for help
mouse tuberoinfundibular peptide 7-39
Database Links Click here for help
GtoPdb PubChem SID 135652607
Search Google for chemical match using the InChIKey VDGRLJCTLFDSRL-ZBGVNHJGSA-N
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Search UniChem for chemical match using the InChIKey VDGRLJCTLFDSRL-ZBGVNHJGSA-N
Search UniChem for chemicals with the same backbone VDGRLJCTLFDSRL