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#22;BENZYL_(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->3)-(4,6-DI-O-ACETYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL)-(1->3)-(2,4,6-TRI-O-BENZ
SpectraBase Compound ID KNUTySImBch
InChI InChI=1S/C91H101NO28/c1-55-56(2)87(100)92(86(55)99)74-79(119-91-85(113-62(8)98)82(112-61(7)97)78(111-60(6)96)73(117-91)54-104-58(4)94)76(110-59(5)95)72(53-103-57(3)93)114-88(74)120-81-75(105-46-65-34-20-11-21-35-65)70(51-101-44-63-30-16-9-17-31-63)116-90(84(81)108-49-68-40-26-14-27-41-68)118-77-71(52-102-45-64-32-18-10-19-33-64)115-89(109-50-69-42-28-15-29-43-69)83(107-48-67-38-24-13-25-39-67)80(77)106-47-66-36-22-12-23-37-66/h9-43,70-85,88-91H,44-54H2,1-8H3/t70-,71+,72-,73-,74-,75+,76-,77+,78+,79-,80-,81+,82+,83+,84-,85-,88+,89+,90+,91+/m0/s1
InChIKey JONOJWRXYZUAEI-FFJIARERSA-N
Mol Weight 1656.8 g/mol
Molecular Formula C91H101NO28
Exact Mass 1655.651012 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JV19ApXjc07
Name #22;BENZYL_(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->3)-(4,6-DI-O-ACETYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL)-(1->3)-(2,4,6-TRI-O-BENZ
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C91H101NO28
InChI InChI=1S/C91H101NO28/c1-55-56(2)87(100)92(86(55)99)74-79(119-91-85(113-62(8)98)82(112-61(7)97)78(111-60(6)96)73(117-91)54-104-58(4)94)76(110-59(5)95)72(53-103-57(3)93)114-88(74)120-81-75(105-46-65-34-20-11-21-35-65)70(51-101-44-63-30-16-9-17-31-63)116-90(84(81)108-49-68-40-26-14-27-41-68)118-77-71(52-102-45-64-32-18-10-19-33-64)115-89(109-50-69-42-28-15-29-43-69)83(107-48-67-38-24-13-25-39-67)80(77)106-47-66-36-22-12-23-37-66/h9-43,70-85,88-91H,44-54H2,1-8H3/t70-,71+,72-,73-,74-,75+,76-,77+,78+,79-,80-,81+,82+,83+,84-,85-,88+,89+,90+,91+/m0/s1
InChIKey JONOJWRXYZUAEI-FFJIARERSA-N
Literature Reference Author M.R.E.ALY,E.S.I.IBRAHIM,E.S.H.E.ASHRY,R.R.SCHMIDT
Literature Reference Citation CARBOHYDR.RES.,316,121(1999)
Literature Reference DOI 10.1016/S0008-6215(99)00051-8
Molecular Weight 1656.793 g/mol
Solvent CDCl3
Source File Reference UWMZ4802