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METHYL 2,4,6-TRI-O-BENZOYL-3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-MANNOPYRANOSYLPHOSPHORYL)-ALPHA-D-MANNOPYRANOSIDE, TRIETHYLAMMONIUM SALT
SpectraBase Compound ID 8VBIzCkf4ZH
InChI InChI=1S/C62H61O17P.C6H15N/c1-68-61-57(77-60(65)49-35-21-8-22-36-49)55(53(76-59(64)48-33-19-7-20-34-48)51(74-61)42-73-58(63)47-31-17-6-18-32-47)78-80(66,67)79-62-56(72-40-46-29-15-5-16-30-46)54(71-39-45-27-13-4-14-28-45)52(70-38-44-25-11-3-12-26-44)50(75-62)41-69-37-43-23-9-2-10-24-43;1-4-7(5-2)6-3/h2-36,50-57,61-62H,37-42H2,1H3,(H,66,67);4-6H2,1-3H3/t50-,51-,52-,53-,54+,55+,56+,57+,61+,62-;/m1./s1
InChIKey XAVHCKCNIZHAPP-FEVCUKFUSA-N
Mol Weight 1210.3 g/mol
Molecular Formula C68H76NO17P
Exact Mass 1209.485087 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CbdQI83Ull9
Name METHYL 3-O-(2,3,4,6-TETRA-O-BENZYL-ALPHA-D-MANNOPYRANOSYLPHOSPHO)-2,4,6-TRI-O-BENZOYL-ALPHA-D-MANNOPYRANOSIDE, TRIETHYLAMMONIUM SALT
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C68H76NO17P
InChI InChI=1S/C62H61O17P.C6H15N/c1-68-61-57(77-60(65)49-35-21-8-22-36-49)55(53(76-59(64)48-33-19-7-20-34-48)51(74-61)42-73-58(63)47-31-17-6-18-32-47)78-80(66,67)79-62-56(72-40-46-29-15-5-16-30-46)54(71-39-45-27-13-4-14-28-45)52(70-38-44-25-11-3-12-26-44)50(75-62)41-69-37-43-23-9-2-10-24-43;1-4-7(5-2)6-3/h2-36,50-57,61-62H,37-42H2,1H3,(H,66,67);4-6H2,1-3H3/t50-,51-,52-,53-,54+,55+,56+,57+,61+,62-;/m1./s1
InChIKey XAVHCKCNIZHAPP-FEVCUKFUSA-N
Instrument Name Bruker WM-250
Literature Reference A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV, N.K.KOCHETKOV (1990)Bioorganich.Khim.(Russ. Lang.): v.16, N5, 674-684.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3