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N-(TERT.-BUTOXYCARBONYL)-4-BENZYL-L-ASPARTYL-5-BENZYL-L-GLUTAMYL-O-BENZYL-L-THREONINE-METHYLESTER

View entire compound with spectra: 1 NMR

N-(TERT.-BUTOXYCARBONYL)-4-BENZYL-L-ASPARTYL-5-BENZYL-L-GLUTAMYL-O-BENZYL-L-THREONINE-METHYLESTER
SpectraBase Compound ID CxdKgHH5Z22
InChI InChI=1S/C40H49N3O11/c1-27(51-24-28-15-9-6-10-16-28)35(38(48)50-5)43-36(46)31(21-22-33(44)52-25-29-17-11-7-12-18-29)41-37(47)32(42-39(49)54-40(2,3)4)23-34(45)53-26-30-19-13-8-14-20-30/h6-20,27,31-32,35H,21-26H2,1-5H3,(H,41,47)(H,42,49)(H,43,46)
InChIKey SYSJHEUDCIESFI-UHFFFAOYSA-N
Mol Weight 747.8 g/mol
Molecular Formula C40H49N3O11
Exact Mass 747.336709 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BzokwdhQlGF
Name N-(TERT.-BUTOXYCARBONYL)-4-BENZYL-L-ASPARTYL-5-BENZYL-L-GLUTAMYL-O-BENZYL-L-THREONINE-METHYLESTER
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H49N3O11
InChI InChI=1S/C40H49N3O11/c1-27(51-24-28-15-9-6-10-16-28)35(38(48)50-5)43-36(46)31(21-22-33(44)52-25-29-17-11-7-12-18-29)41-37(47)32(42-39(49)54-40(2,3)4)23-34(45)53-26-30-19-13-8-14-20-30/h6-20,27,31-32,35H,21-26H2,1-5H3,(H,41,47)(H,42,49)(H,43,46)
InChIKey SYSJHEUDCIESFI-UHFFFAOYSA-N
Literature Reference Author T.KANEMITSU,Y.OGIHARA,T.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,45,643(1997)
Literature Reference DOI 10.1248/cpb.45.643
Molecular Weight 747.843 g/mol
Solvent CDCl3
Source File Reference UWVN28791