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ARGIFIN;CYCLO-(N-(OMEGA)-(N-METHYLCARBAMOYL)-L-ARGINYL-N-METHYL-L-PHENYLALANYL-BETA-L-ASPARTYL-D-ALANYL
SpectraBase Compound ID HzZuWA5KjZI
InChI InChI=1S/C29H41N9O10/c1-15-23(41)35-17(10-7-11-32-28(30)37-29(48)31-2)25(43)38(3)20(12-16-8-5-4-6-9-16)24(42)36-19(27(46)47)14-22(40)34-18(26(44)45)13-21(39)33-15/h4-6,8-9,15,17-20H,7,10-14H2,1-3H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)(H,44,45)(H,46,47)(H4,30,31,32,37,48)
InChIKey UHBHXSDKGLPPGO-UHFFFAOYSA-N
Mol Weight 675.7 g/mol
Molecular Formula C29H41N9O10
Exact Mass 675.297639 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BzbbkCK5N7C
Name ARGIFIN;CYCLO-(N-(OMEGA)-(N-METHYLCARBAMOYL)-L-ARGINYL-N-METHYL-L-PHENYLALANYL-BETA-L-ASPARTYL-D-ALANYL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H41N9O10
InChI InChI=1S/C29H41N9O10/c1-15-23(41)35-17(10-7-11-32-28(30)37-29(48)31-2)25(43)38(3)20(12-16-8-5-4-6-9-16)24(42)36-19(27(46)47)14-22(40)34-18(26(44)45)13-21(39)33-15/h4-6,8-9,15,17-20H,7,10-14H2,1-3H3,(H,33,39)(H,34,40)(H,35,41)(H,36,42)(H,44,45)(H,46,47)(H4,30,31,32,37,48)
InChIKey UHBHXSDKGLPPGO-UHFFFAOYSA-N
Literature Reference Author N.ARAI,K.SHIOMI,Y.IWAI,S.OMURA
Literature Reference Citation J.ANTIBIOTICS,53,609(2000)
Literature Reference DOI 10.7164/antibiotics.53.609
Molecular Weight 675.699 g/mol
Solvent D2O:TFA=249:1;PH=4
Source File Reference UWRU8147