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METHYL-6-(2-ACETAMIDO-4,6-DI-O-BENZOYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSYLPHOSPHO)-2,3,4-TRI-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID 3wXEbhfCp7w
InChI InChI=1S/C35H42NO19P.C6H15N/c1-18(37)36-26-27(41)28(54-33(43)23-14-10-7-11-15-23)24(16-47-32(42)22-12-8-6-9-13-22)52-34(26)55-56(44,45)48-17-25-29(49-19(2)38)30(50-20(3)39)31(51-21(4)40)35(46-5)53-25;1-4-7(5-2)6-3/h6-15,24-31,34-35,41H,16-17H2,1-5H3,(H,36,37)(H,44,45);4-6H2,1-3H3/t24-,25-,26-,27-,28-,29-,30+,31+,34-,35+;/m1./s1
InChIKey KRCMKZRCASCFSG-WXISHYGUSA-N
Mol Weight 912.9 g/mol
Molecular Formula C41H57N2O19P
Exact Mass 912.329315 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BWGtXoO8tiz
Name METHYL-6-(2-ACETAMIDO-4,6-DI-O-BENZOYL-2-DEOXY-ALPHA-D-GLUCOPYRANOSYLPHOSPHO)-2,3,4-TRI-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C41H57N2O19P
InChI InChI=1S/C35H42NO19P.C6H15N/c1-18(37)36-26-27(41)28(54-33(43)23-14-10-7-11-15-23)24(16-47-32(42)22-12-8-6-9-13-22)52-34(26)55-56(44,45)48-17-25-29(49-19(2)38)30(50-20(3)39)31(51-21(4)40)35(46-5)53-25;1-4-7(5-2)6-3/h6-15,24-31,34-35,41H,16-17H2,1-5H3,(H,36,37)(H,44,45);4-6H2,1-3H3/t24-,25-,26-,27-,28-,29-,30+,31+,34-,35+;/m1./s1
InChIKey KRCMKZRCASCFSG-WXISHYGUSA-N
Instrument Name Bruker AC-200
Literature Reference A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV (1992) Bioorganich.Khim.(Russ. Lang.):v.18, N1, 126-141.
NMR Standard H3PO4 85%
Observed nucleus 31P
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d