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D-Glucopyranosylamine, N-(4-methylphenyl)-2-O-(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)-, 3,4,6-triacetate
SpectraBase Compound ID 8FkxsEvunXg
InChI InChI=1S/C33H43NO17/c1-15-9-11-23(12-10-15)34-32-30(28(46-20(6)39)26(44-18(4)37)24(49-32)13-42-16(2)35)51-33-31(48-22(8)41)29(47-21(7)40)27(45-19(5)38)25(50-33)14-43-17(3)36/h9-12,24-34H,13-14H2,1-8H3
InChIKey MQUIEDBIZZKLOC-UHFFFAOYSA-N
Mol Weight 725.7 g/mol
Molecular Formula C33H43NO17
Exact Mass 725.253099 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84aET0071Rt
Name D-Glucopyranosylamine, N-(4-methylphenyl)-2-O-(2,3,4,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)-, 3,4,6-triacetate
Alternate Name(s) 3,4,6-Tri-O-acetyl-N-(4-methylphenyl)-2-O-(2,3,4,6-tetra-O-acetylhexopyranosyl)hexopyranosylamine [3,4-diacetoxy-6-(4-methylanilino)-5-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]methyl acetate [3,4-diacetyloxy-6-(4-methylanilino)-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate [3,4-diacetyloxy-6-[(4-methylphenyl)amino]-5-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-oxan-2-yl]methyl ethanoate Acetic acid [3,4-diacetyloxy-6-(4-methylanilino)-5-[[3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]oxy]-2-oxanyl]methyl ester
CAS Registry Number 35427-13-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H43NO17
InChI InChI=1S/C33H43NO17/c1-15-9-11-23(12-10-15)34-32-30(28(46-20(6)39)26(44-18(4)37)24(49-32)13-42-16(2)35)51-33-31(48-22(8)41)29(47-21(7)40)27(45-19(5)38)25(50-33)14-43-17(3)36/h9-12,24-34H,13-14H2,1-8H3
InChIKey MQUIEDBIZZKLOC-UHFFFAOYSA-N
Molecular Weight 725.697 g/mol
SMILES N(c1ccc(C)cc1)C1C(C(C(C(COC(C)=O)O1)OC(C)=O)OC(C)=O)OC1C(C(C(C(COC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O
SPLASH splash10-067r-1911000000-642bf3359871a8858ae8
Source of Spectrum O-5-1159-8
Wiley ID 1415770