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#9;METHYL-2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3,6-DI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL-(1->6)-2,3,4-TRI-O-BENZYL-ALPHA-D-MAN
SpectraBase Compound ID 4A8M0dzx4bm
InChI InChI=1S/C54H67NO22/c1-30(56)55-43-47(71-34(5)60)45(77-54-51(73-36(7)62)49(72-35(6)61)46(70-33(4)59)42(76-54)28-65-32(3)58)41(27-64-31(2)57)74-52(43)69-29-40-44(66-24-37-18-12-9-13-19-37)48(67-25-38-20-14-10-15-21-38)50(53(63-8)75-40)68-26-39-22-16-11-17-23-39/h9-23,40-54H,24-29H2,1-8H3,(H,55,56)/t40-,41+,42+,43+,44-,45+,46-,47+,48+,49-,50+,51+,52+,53+,54-/m1/s1
InChIKey HQKVZCJQORIFDX-BYUCHYICSA-N
Mol Weight 1082.1 g/mol
Molecular Formula C54H67NO22
Exact Mass 1081.415473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7zhNdoydLft
Name #9;METHYL-2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(1->4)-2-ACETAMIDO-3,6-DI-O-ACETYL-2-DEOXY-BETA-D-GLUCOPYRANOSYL-(1->6)-2,3,4-TRI-O-BENZYL-ALPHA-D-MAN
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C54H67NO22
InChI InChI=1S/C54H67NO22/c1-30(56)55-43-47(71-34(5)60)45(77-54-51(73-36(7)62)49(72-35(6)61)46(70-33(4)59)42(76-54)28-65-32(3)58)41(27-64-31(2)57)74-52(43)69-29-40-44(66-24-37-18-12-9-13-19-37)48(67-25-38-20-14-10-15-21-38)50(53(63-8)75-40)68-26-39-22-16-11-17-23-39/h9-23,40-54H,24-29H2,1-8H3,(H,55,56)/t40-,41+,42+,43+,44-,45+,46-,47+,48+,49-,50+,51+,52+,53+,54-/m1/s1
InChIKey HQKVZCJQORIFDX-BYUCHYICSA-N
Literature Reference Author X.F.JIN,X.B.MENG,K.J.LIAO,Q.LI,Z.J.LI
Literature Reference Citation J.CHIN.PHARM.SCI.,17,272(2008)
Molecular Weight 1082.119 g/mol
Solvent CDCl3
Source File Reference UWIR7268