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N-ACETYL_4-C-(3,7-ANHYDRO-4,5,6,8-TETRA-O-ACETYL-1,1,2,2-TETRADEHYDRO-1,2-D-GLYCERO-D-GULOOCTITYL)-DL-PHENYLALANINE_METHYLESTER

View entire compound with spectra: 1 NMR

N-ACETYL_4-C-(3,7-ANHYDRO-4,5,6,8-TETRA-O-ACETYL-1,1,2,2-TETRADEHYDRO-1,2-D-GLYCERO-D-GULOOCTITYL)-DL-PHENYLALANINE_METHYLESTER
SpectraBase Compound ID 5WSxODvpCE
InChI InChI=1S/C28H33NO12/c1-15(30)29-22(28(35)36-6)13-21-9-7-20(8-10-21)11-12-23-25(38-17(3)32)27(40-19(5)34)26(39-18(4)33)24(41-23)14-37-16(2)31/h7-10,22-27H,13-14H2,1-6H3,(H,29,30)/t22?,23-,24+,25-,26+,27+/m0/s1
InChIKey JBWXOEGQOKPJNS-GYVOAOTASA-N
Mol Weight 575.6 g/mol
Molecular Formula C28H33NO12
Exact Mass 575.200275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID c1GvkoOmax
Name N-ACETYL_4-C-(3,7-ANHYDRO-4,5,6,8-TETRA-O-ACETYL-1,1,2,2-TETRADEHYDRO-1,2-D-GLYCERO-D-GULOOCTITYL)-DL-PHENYLALANINE_METHYLESTER
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H33NO12
InChI InChI=1S/C28H33NO12/c1-15(30)29-22(28(35)36-6)13-21-9-7-20(8-10-21)11-12-23-25(38-17(3)32)27(40-19(5)34)26(39-18(4)33)24(41-23)14-37-16(2)31/h7-10,22-27H,13-14H2,1-6H3,(H,29,30)/t22?,23-,24+,25-,26+,27+/m0/s1
InChIKey JBWXOEGQOKPJNS-GYVOAOTASA-N
Literature Reference Author T.LOWARY,M.MELDAL,A.HELMBOLDT,A.VASELLA,K.BOCK
Literature Reference Citation J.ORG.CHEM.,63,9657(1998)
Literature Reference DOI 10.1021/jo980517h
Molecular Weight 575.570 g/mol
Sample ID 26618
Solvent CDCl3