PTHrP-(1-21)/PTH-(22-34) (human)   Click here for help

GtoPdb Ligand ID: 1788

Synonyms: hybrid of human PTHrP and human PTH
Comment: Synthetic hybrid of human PTHrP and PTH 22-34
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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)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)Cc1ccccc1)CC(=O)N)Cc1nc[nH]c1)C(C)C)CC(=O)O)CCC(=O)N)CC(C)C)CCCCN)CCCCN)CCCN=C(N)N)CC(C)C)Cc1c[nH]c2c1cccc2)CCC(=O)O)CCCN=C(N)N)CCCN=C(N)N)CCCN=C(N)N)CC(C)C)CC(=O)O)CCC(=O)N)C(CC)C)CO)NC(=O)CNC(=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(C(C)C)NC(=O)C(N)C)CO)CCC(=O)O)Cc1nc[nH]c1)CCC(=O)N)CC(C)C)CC(C)C)Cc1nc[nH]c1)CC(=O)O)CCCCN
Isomeric SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)C(C)C
InChI InChI=1S/C184H299N61O51/c1-18-97(16)147(245-176(291)134(86-247)241-150(265)107(41-25-29-59-186)214-139(252)84-210-149(264)106(40-24-28-58-185)215-172(287)129(77-142(257)258)238-169(284)126(74-102-82-203-88-212-102)234-166(281)123(70-94(10)11)229-165(280)122(69-93(8)9)228-157(272)114(48-53-135(190)248)224-168(283)125(73-101-81-202-87-211-101)233-161(276)118(52-57-141(255)256)225-175(290)133(85-246)242-178(293)145(95(12)13)243-148(263)98(17)189)179(294)226-116(50-55-137(192)250)159(274)236-130(78-143(259)260)173(288)231-121(68-92(6)7)163(278)221-113(47-35-65-208-184(200)201)154(269)218-110(44-32-62-205-181(194)195)152(267)219-111(45-33-63-206-182(196)197)155(270)222-117(51-56-140(253)254)160(275)232-124(72-100-80-209-105-39-23-22-38-104(100)105)167(282)230-120(67-91(4)5)162(277)220-112(46-34-64-207-183(198)199)153(268)216-108(42-26-30-60-187)151(266)217-109(43-27-31-61-188)156(271)227-119(66-90(2)3)164(279)223-115(49-54-136(191)249)158(273)237-131(79-144(261)262)174(289)244-146(96(14)15)177(292)239-127(75-103-83-204-89-213-103)170(285)235-128(76-138(193)251)171(286)240-132(180(295)296)71-99-36-20-19-21-37-99/h19-23,36-39,80-83,87-98,106-134,145-147,209,246-247H,18,24-35,40-79,84-86,185-189H2,1-17H3,(H2,190,248)(H2,191,249)(H2,192,250)(H2,193,251)(H,202,211)(H,203,212)(H,204,213)(H,210,264)(H,214,252)(H,215,287)(H,216,268)(H,217,266)(H,218,269)(H,219,267)(H,220,277)(H,221,278)(H,222,270)(H,223,279)(H,224,283)(H,225,290)(H,226,294)(H,227,271)(H,228,272)(H,229,280)(H,230,282)(H,231,288)(H,232,275)(H,233,276)(H,234,281)(H,235,285)(H,236,274)(H,237,273)(H,238,284)(H,239,292)(H,240,286)(H,241,265)(H,242,293)(H,243,263)(H,244,289)(H,245,291)(H,253,254)(H,255,256)(H,257,258)(H,259,260)(H,261,262)(H,295,296)(H4,194,195,205)(H4,196,197,206)(H4,198,199,207)(H4,200,201,208)/t97-,98-,106-,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-,133-,134-,145-,146-,147-/m0/s1
InChI Key XAFMSRGNPGABMT-AXOOKYBDSA-N
Classification Click here for help
Compound class Peptide or derivative
Synonyms Click here for help
hybrid of human PTHrP and human PTH
Database Links Click here for help
GtoPdb PubChem SID 135652421
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