#C2;ALPHA,ALPHA'-BIS-[4-[2-ACETAMIDO-2-DEOXY-4-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-BETA-D-GLUCOPYRANOSYL-OXYMETHYL]-1H-1,2,3-TRIAZOLE-1-YL]-ME

SpectraBase Compound ID	5NfZhCme08K
InChI	InChI=1S/C46H68N10O22/c1-19(61)47-31-37(67)35(65)27(13-57)73-45(31)77-41-29(15-59)75-43(33(39(41)69)49-21(3)63)71-17-25-11-55(53-51-25)9-23-6-5-7-24(8-23)10-56-12-26(52-54-56)18-72-44-34(50-22(4)64)40(70)42(30(16-60)76-44)78-46-32(48-20(2)62)38(68)36(66)28(14-58)74-46/h5-8,11-12,27-46,57-60,65-70H,9-10,13-18H2,1-4H3,(H,47,61)(H,48,62)(H,49,63)(H,50,64)/t27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45+,46+/m1/s1
InChIKey	MGHZEDRIRCEROS-XQPPWEJASA-N Google Search
Mol Weight	1113.1 g/mol
Molecular Formula	C46H68N10O22
Exact Mass	1112.450964 g/mol

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SpectraBase Spectrum ID	Hq4yHAJHsBZ
Name	#C2;ALPHA,ALPHA'-BIS-[4-[2-ACETAMIDO-2-DEOXY-4-O-(2-ACETAMIDO-2-DEOXY-BETA-D-GLUCOPYRANOSYL)-BETA-D-GLUCOPYRANOSYL-OXYMETHYL]-1H-1,2,3-TRIAZOLE-1-YL]-ME
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C46H68N10O22
InChI	InChI=1S/C46H68N10O22/c1-19(61)47-31-37(67)35(65)27(13-57)73-45(31)77-41-29(15-59)75-43(33(39(41)69)49-21(3)63)71-17-25-11-55(53-51-25)9-23-6-5-7-24(8-23)10-56-12-26(52-54-56)18-72-44-34(50-22(4)64)40(70)42(30(16-60)76-44)78-46-32(48-20(2)62)38(68)36(66)28(14-58)74-46/h5-8,11-12,27-46,57-60,65-70H,9-10,13-18H2,1-4H3,(H,47,61)(H,48,62)(H,49,63)(H,50,64)/t27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,45+,46+/m1/s1
InChIKey	MGHZEDRIRCEROS-XQPPWEJASA-N
Literature Reference Author	H.S.G.BECKMANN,H.M.MOELLER,V.WITTMANN
Literature Reference Citation	BEIL.J.ORG.CHEM.,8,819(2012)
Literature Reference DOI	10.3762/bjoc.8.91
Molecular Weight	1113.100 g/mol
Solvent	DMSO-D6
Source File Reference	UWIR10910