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#28;METHYL-3-O-ACETYL-6-O-BENZYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL-(1->4)-3,6-DI-O-BENZYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL-(1-
SpectraBase Compound ID JGtHhrOH3li
InChI InChI=1S/C69H77N3O21/c1-37-38(2)62(77)70(61(37)76)52-58(87-43(7)73)55(75)49(34-83-30-45-22-14-10-15-23-45)89-68(52)92-56-50(35-84-31-46-24-16-11-17-25-46)91-69(53(71-63(78)39(3)40(4)64(71)79)59(56)86-33-48-28-20-13-21-29-48)93-57-51(36-85-32-47-26-18-12-19-27-47)90-67(82-9)54(60(57)88-44(8)74)72-65(80)41(5)42(6)66(72)81/h10-29,49-60,67-69,75H,30-36H2,1-9H3/t49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,67-,68+,69+/m0/s1
InChIKey KEURYVILAMNVFG-HVXPLXGTSA-N
Mol Weight 1284.4 g/mol
Molecular Formula C69H77N3O21
Exact Mass 1283.504956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4rvv2dMKJzc
Name #28;METHYL-3-O-ACETYL-6-O-BENZYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL-(1->4)-3,6-DI-O-BENZYL-2-DEOXY-2-DIMETHYLMALEIMIDO-BETA-D-GLUCOPYRANOSYL-(1-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C69H77N3O21
InChI InChI=1S/C69H77N3O21/c1-37-38(2)62(77)70(61(37)76)52-58(87-43(7)73)55(75)49(34-83-30-45-22-14-10-15-23-45)89-68(52)92-56-50(35-84-31-46-24-16-11-17-25-46)91-69(53(71-63(78)39(3)40(4)64(71)79)59(56)86-33-48-28-20-13-21-29-48)93-57-51(36-85-32-47-26-18-12-19-27-47)90-67(82-9)54(60(57)88-44(8)74)72-65(80)41(5)42(6)66(72)81/h10-29,49-60,67-69,75H,30-36H2,1-9H3/t49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,67-,68+,69+/m0/s1
InChIKey KEURYVILAMNVFG-HVXPLXGTSA-N
Literature Reference Author D.HESEK,M.LEE,K.I.MORIO,S.MOBASHERY
Literature Reference Citation J.ORG.CHEM.,69,2137(2004)
Literature Reference DOI 10.1021/jo035583k
Molecular Weight 1284.378 g/mol
Solvent CDCl3
Source File Reference UWVN21960