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BETA-BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLGLUTAMYL]-GAMMA-SARCOSYL-[ALPHA-METHYL-(2R)-ASPARTATE]-TRIESTER;ROTAMER-#2

View entire compound with spectra: 1 NMR

BETA-BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLGLUTAMYL]-GAMMA-SARCOSYL-[ALPHA-METHYL-(2R)-ASPARTATE]-TRIESTER;ROTAMER-#2
SpectraBase Compound ID HnPuOMKzS3Q
InChI InChI=1S/C26H37N3O10/c1-26(2,3)39-25(35)28-18(23(33)36-5)12-13-21(31)29(4)15-20(30)27-19(24(34)37-6)14-22(32)38-16-17-10-8-7-9-11-17/h7-11,18-19H,12-16H2,1-6H3,(H,27,30)(H,28,35)/t18-,19+/m0/s1
InChIKey YZVQIGMNYLSXQV-RBUKOAKNSA-N
Mol Weight 551.6 g/mol
Molecular Formula C26H37N3O10
Exact Mass 551.247894 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EMExoWB8av
Name BETA-BENZYL-[(2R)-N-(TERT.-BUTOXYCARBONYL)-ALPHA-METHYLGLUTAMYL]-GAMMA-SARCOSYL-[ALPHA-METHYL-(2R)-ASPARTATE]-TRIESTER;ROTAMER-#2
Compound Number 37
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H37N3O10
InChI InChI=1S/C26H37N3O10/c1-26(2,3)39-25(35)28-18(23(33)36-5)12-13-21(31)29(4)15-20(30)27-19(24(34)37-6)14-22(32)38-16-17-10-8-7-9-11-17/h7-11,18-19H,12-16H2,1-6H3,(H,27,30)(H,28,35)/t18-,19+/m0/s1
InChIKey YZVQIGMNYLSXQV-RBUKOAKNSA-N
Literature Reference Author A.P.MEHROTRA,K.L.WEBSTER,D.GANI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2495(1997)
Literature Reference DOI 10.1039/a702407j
Molecular Weight 551.594 g/mol
Solvent DMSO-D6
Source File Reference UWCP9229