#25;METHYL-6-DEOXY-6-[N'-[6-DEOXY-6-[N'-[6-DEOXY-6-[N'-(2,3,4-TRI-O-ACETYL-6-AZIDO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYL]-THI

SpectraBase Compound ID	5jdQdOhuPsu
InChI	InChI=1S/C34H55N9O20S3/c1-9(44)57-25-15(8-39-43-35)62-30(27(59-11(3)46)26(25)58-10(2)45)42-34(66)37-6-13-17(48)20(51)22(53)28(61-13)40-32(64)36-5-12-16(47)19(50)23(54)29(60-12)41-33(65)38-7-14-18(49)21(52)24(55)31(56-4)63-14/h12-31,47-55H,5-8H2,1-4H3,(H2,36,40,64)(H2,37,42,66)(H2,38,41,65)/t12-,13-,14-,15+,16-,17-,18-,19+,20+,21+,22-,23-,24-,25+,26-,27+,28-,29-,30+,31+/m0/s1
InChIKey	MEXQMSMXBIODAJ-WVGYTIMUSA-N Google Search
Mol Weight	1006.0 g/mol
Molecular Formula	C34H55N9O20S3
Exact Mass	1005.272549 g/mol

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SpectraBase Spectrum ID	LY5TCVeuupw
Name	#25;METHYL-6-DEOXY-6-[N'-[6-DEOXY-6-[N'-[6-DEOXY-6-[N'-(2,3,4-TRI-O-ACETYL-6-AZIDO-6-DEOXY-BETA-D-GLUCOPYRANOSYL)-THIOUREIDO]-BETA-D-GLUCOPYRANOSYL]-THI
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C34H55N9O20S3
InChI	InChI=1S/C34H55N9O20S3/c1-9(44)57-25-15(8-39-43-35)62-30(27(59-11(3)46)26(25)58-10(2)45)42-34(66)37-6-13-17(48)20(51)22(53)28(61-13)40-32(64)36-5-12-16(47)19(50)23(54)29(60-12)41-33(65)38-7-14-18(49)21(52)24(55)31(56-4)63-14/h12-31,47-55H,5-8H2,1-4H3,(H2,36,40,64)(H2,37,42,66)(H2,38,41,65)/t12-,13-,14-,15+,16-,17-,18-,19+,20+,21+,22-,23-,24-,25+,26-,27+,28-,29-,30+,31+/m0/s1
InChIKey	MEXQMSMXBIODAJ-WVGYTIMUSA-N
Literature Reference Author	J.L.J.BLANCO,P.BOOTELLO,C.O.MELLET,J.M.G.FERNANDEZ
Literature Reference Citation	EUR.J.ORG.CHEM.,183(2006)
Molecular Weight	1006.039 g/mol
Sample ID	42782
Solvent	D2O