TERT-BUTYLOXYCARBONYL-VALINE-GLYCINE-(BENZYLOXYCARBONYL)LYSINE-(BENZYLOXYCARBONYL)LYSINE-[N(OMEGA)-NITRO]ARGININE-[N(OMEGA)-NITRO]ARGININE-PROLINE HEPTAPEPTIDE

SpectraBase Compound ID	CTeaR6gjHMm
InChI	InChI=1S/C57H87N17O18/c1-36(2)45(69-56(85)92-57(3,4)5)49(79)64-33-44(75)65-39(23-12-14-28-62-54(83)90-34-37-19-8-6-9-20-37)46(76)66-40(24-13-15-29-63-55(84)91-35-38-21-10-7-11-22-38)47(77)67-41(25-16-30-60-52(58)70-73(86)87)48(78)68-42(26-17-31-61-53(59)71-74(88)89)50(80)72-32-18-27-43(72)51(81)82/h6-11,19-22,36,39-43,45H,12-18,23-35H2,1-5H3,(H,62,83)(H,63,84)(H,64,79)(H,65,75)(H,66,76)(H,67,77)(H,68,78)(H,69,85)(H,81,82)(H3,58,60,70)(H3,59,61,71)/t39-,40-,41-,42-,43-,45-/m1/s1
InChIKey	RHPOSPMDQXFCFU-VCXNCESJSA-N Google Search
Mol Weight	1298.4 g/mol
Molecular Formula	C57H87N17O18
Exact Mass	1297.641499 g/mol

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SpectraBase Spectrum ID	ERizNSTbTk1
Name	TERT-BUTYLOXYCARBONYL-VALINE-GLYCINE-(BENZYLOXYCARBONYL)LYSINE-(BENZYLOXYCARBONYL)LYSINE-[N(OMEGA)-NITRO]ARGININE-[N(OMEGA)-NITRO]ARGININE-PROLINE HEPTAPEPTIDE
Copyright	Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula	C57H87N17O18
InChI	InChI=1S/C57H87N17O18/c1-36(2)45(69-56(85)92-57(3,4)5)49(79)64-33-44(75)65-39(23-12-14-28-62-54(83)90-34-37-19-8-6-9-20-37)46(76)66-40(24-13-15-29-63-55(84)91-35-38-21-10-7-11-22-38)47(77)67-41(25-16-30-60-52(58)70-73(86)87)48(78)68-42(26-17-31-61-53(59)71-74(88)89)50(80)72-32-18-27-43(72)51(81)82/h6-11,19-22,36,39-43,45H,12-18,23-35H2,1-5H3,(H,62,83)(H,63,84)(H,64,79)(H,65,75)(H,66,76)(H,67,77)(H,68,78)(H,69,85)(H,81,82)(H3,58,60,70)(H3,59,61,71)/t39-,40-,41-,42-,43-,45-/m1/s1
InChIKey	RHPOSPMDQXFCFU-VCXNCESJSA-N
Instrument Name	Bruker WP-80
Literature Reference	V.I.SVERGUN, M.B.SMIRNOV, V.N.KAREL'SKY, V.P.PANOV, E.P.KRYSIN (1980)Khim.Farm.Zhurn.(Russ. Lang.): N6, 97-101.
NMR Standard	DMSO-D6
Origin	Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent	C2D6SO dimethylsulfo