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Glycyl-lysyl-arginyl-8-lysine vasopressin [100442-96-4]

 
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Identification
Copyright
CAS # 100442-96-4, Glycyl-lysyl-arginyl-8-lysine vasopressin
Name
Glycyl-lysyl-arginyl-8-lysine vasopressin
Synonyms
Glycyl-Lysyl-Arginyl-8-Lysine Vasopressin; V-Glal; Vasopressin, Gly-Lys-Arg-8-Lys-
Molecular Formula
C60H91N19O16S2
Molecular Weight 1398.62
CAS Registry Number
100442-96-4
SMILES
[C@@H](C(NCC(NCC(N[C@H](C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)CCCCN)=O)=O)=O)(CCCCN)NC(=O)[C@H]1N(CCC1)C(=O)[C@@H]2CSSC[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N2)=O)CC(N)=O)=O)CCC(N)=O)=O)CC3=CC=CC=C3)=O)CC4=CC=C(C=C4)O)=O)N
InChI
1S/C60H91N19O16S2/c61-22-6-4-12-37(51(86)70-29-48(83)69-30-49(84)71-38(13-5-7-23-62)52(87)74-40(59(94)95)14-8-24-68-60(66)67)73-57(92)45-15-9-25-79(45)58(93)44-32-97-96-31-36(63)50(85)75-41(27-34-16-18-35(80)19-17-34)55(90)76-42(26-33-10-2-1-3-11-33)54(89)72-39(20-21-46(64)81)53(88)77-43(28-47(65)82)56(91)78-44/h1-3,10-11,16-19,36-45,80H,4-9,12-15,20-32,61-63H2,(H2,64,81)(H2,65,82)(H,69,83)(H,70,86)(H,71,84)(H,72,89)(H,73,92)(H,74,87)(H,75,85)(H,76,90)(H,77,88)(H,78,91)(H,94,95)(H4,66,67,68)/t36-,37-,38-,39-,40-,41-,42-,43-,44-,45-/m0/s1
InChIKey ZGMYVOZLIAAIGZ-BQBSFLCNSA-N
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