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#5B;(N(ALPHA)-(TERT.-BUTOXYCARBONYL)-C-[(2',3',4',6'-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSYL)-(1'->4)-(6-O-ACETYL-2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSYL)
SpectraBase Compound ID D9awlZ5ZiGG
InChI InChI=1S/C44H55NO17/c1-25(46)53-23-36-35(60-42-40(58-29(5)50)39(57-28(4)49)38(56-27(3)48)37(61-42)24-54-26(2)47)19-18-33(59-36)20-30-14-16-31(17-15-30)21-34(45-43(52)62-44(6,7)8)41(51)55-22-32-12-10-9-11-13-32/h9-19,33-40,42H,20-24H2,1-8H3,(H,45,52)/t33-,34+,35-,36+,37-,38-,39+,40-,42+/m1/s1
InChIKey QSBKZNUFVGVMRR-AEGIGKSVSA-N
Mol Weight 869.9 g/mol
Molecular Formula C44H55NO17
Exact Mass 869.346999 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E0ORNcfV0E2
Name #5B;(N(ALPHA)-(TERT.-BUTOXYCARBONYL)-C-[(2',3',4',6'-TETRA-O-ACETYL-ALPHA-D-GLUCOPYRANOSYL)-(1'->4)-(6-O-ACETYL-2,3-DIDEOXY-ALPHA-D-ERYTHRO-HEX-2-ENOPYRANOSYL)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H55NO17
InChI InChI=1S/C44H55NO17/c1-25(46)53-23-36-35(60-42-40(58-29(5)50)39(57-28(4)49)38(56-27(3)48)37(61-42)24-54-26(2)47)19-18-33(59-36)20-30-14-16-31(17-15-30)21-34(45-43(52)62-44(6,7)8)41(51)55-22-32-12-10-9-11-13-32/h9-19,33-40,42H,20-24H2,1-8H3,(H,45,52)/t33-,34+,35-,36+,37-,38-,39+,40-,42+/m1/s1
InChIKey QSBKZNUFVGVMRR-AEGIGKSVSA-N
Literature Reference Author A.J.PEARCE,S.RAMAYA,S.N.THORN,G.B.BLOOMBERG,D.S.WALTER,T.GAL LAGHER
Literature Reference Citation J.ORG.CHEM.,64,5453(1999)
Literature Reference DOI 10.1021/jo990253e
Molecular Weight 869.917 g/mol
Sample ID 41279
Solvent CDCl3