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L-N^2-{N-{1-{N-{N-{N-[1-(1-L-ARGINYL-L-PROLYL)-L-PROLYL]GLYCYL}-3-PHENYL-L-ALANYL}-L-SERYL}-L-PROLYL}-3-PHENYL-L-ALANYL}ARGININE, DIACETATE (SALT), TRIHYDRATE

View entire compound with spectra: 1 FTIR

L-N^2-{N-{1-{N-{N-{N-[1-(1-L-ARGINYL-L-PROLYL)-L-PROLYL]GLYCYL}-3-PHENYL-L-ALANYL}-L-SERYL}-L-PROLYL}-3-PHENYL-L-ALANYL}ARGININE, DIACETATE (SALT), TRIHYDRATE
SpectraBase Compound ID LwRYMvcQILw
InChI InChI=1S/C50H73N15O11.2C2H4O2.3H2O/c51-32(16-7-21-56-49(52)53)45(72)65-25-11-20-39(65)47(74)64-24-9-18-37(64)43(70)58-28-40(67)59-34(26-30-12-3-1-4-13-30)41(68)62-36(29-66)46(73)63-23-10-19-38(63)44(71)61-35(27-31-14-5-2-6-15-31)42(69)60-33(48(75)76)17-8-22-57-50(54)55;2*1-2(3)4;;;/h1-6,12-15,32-39,66H,7-11,16-29,51H2,(H,58,70)(H,59,67)(H,60,69)(H,61,71)(H,62,68)(H,75,76)(H4,52,53,56)(H4,54,55,57);2*1H3,(H,3,4);3*1H2/t32-,33-,34-,35-,36-,37-,38-,39-;;;;;/m0...../s1
InChIKey KRBRURXGWUWCEW-CNIHQCLFSA-N
Mol Weight 1234.4 g/mol
Molecular Formula C54H87N15O18
Exact Mass 1233.635351 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 8sTA23Xbuhd
Name L-N^2-{N-{1-{N-{N-{N-[1-(1-L-ARGINYL-L-PROLYL)-L-PROLYL]GLYCYL}-3-PHENYL-L-ALANYL}-L-SERYL}-L-PROLYL}-3-PHENYL-L-ALANYL}ARGININE, DIACETATE (SALT), TRIHYDRATE
Source of Sample E. Schroeder, Schering AG, Berlin, Germany
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H87N15O18
InChI InChI=1S/C50H73N15O11.2C2H4O2.3H2O/c51-32(16-7-21-56-49(52)53)45(72)65-25-11-20-39(65)47(74)64-24-9-18-37(64)43(70)58-28-40(67)59-34(26-30-12-3-1-4-13-30)41(68)62-36(29-66)46(73)63-23-10-19-38(63)44(71)61-35(27-31-14-5-2-6-15-31)42(69)60-33(48(75)76)17-8-22-57-50(54)55;2*1-2(3)4;;;/h1-6,12-15,32-39,66H,7-11,16-29,51H2,(H,58,70)(H,59,67)(H,60,69)(H,61,71)(H,62,68)(H,75,76)(H4,52,53,56)(H4,54,55,57);2*1H3,(H,3,4);3*1H2/t32-,33-,34-,35-,36-,37-,38-,39-;;;;;/m0...../s1
InChIKey KRBRURXGWUWCEW-CNIHQCLFSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 6922(1964)
Molecular Weight 1234.376953
Synonyms ARGININE, N<2-/N-/1-/N-/N-/N-/1-/1- L-ARGINYL-L-PROLYL/-L-PROLYL/GLYCYL/-3- PHENYL-L-ALANYL/-L-SERYL/-L-PROLYL/-3- PHENYL-L-ALANYL/-, DIACETATE /SALT/, TRIHYDRATE, L-, BRADYKININ, DIACETATE /SALT/, TRIHYDRATE
Technique KBr WAFER