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D-Glucopyranosylamine, N-(4-methylphenyl)-6-O-(2,3,4,6-tetra-O-acetyl-.alpha.-D-galactopyranosyl)-, 2,3,4-triacetate
SpectraBase Compound ID 2AMFl42Yzdo
InChI InChI=1S/C33H43NO17/c1-15-9-11-23(12-10-15)34-32-30(48-21(7)40)28(46-19(5)38)26(44-17(3)36)24(50-32)14-43-33-31(49-22(8)41)29(47-20(6)39)27(45-18(4)37)25(51-33)13-42-16(2)35/h9-12,24-34H,13-14H2,1-8H3
InChIKey ASCUXPQGEXGEMJ-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 ANCgdR9HwUc
Name D-Glucopyranosylamine, N-(4-methylphenyl)-6-O-(2,3,4,6-tetra-O-acetyl-.alpha.-D-galactopyranosyl)-, 2,3,4-triacetate
CAS Registry Number 35427-08-8
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(48-21(7)40)28(46-19(5)38)26(44-17(3)36)24(50-32)14-43-33-31(49-22(8)41)29(47-20(6)39)27(45-18(4)37)25(51-33)13-42-16(2)35/h9-12,24-34H,13-14H2,1-8H3
InChIKey ASCUXPQGEXGEMJ-UHFFFAOYSA-N
Molecular Weight 725.697 g/mol
SMILES N(c1ccc(cc1)C)C1C(C(C(C(COC2C(C(C(C(COC(C)=O)O2)OC(C)=O)OC(C)=O)OC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O
SPLASH splash10-0a4i-1911000000-d53d5fd24aa99cfa7a7d
Source of Spectrum O-5-1159-2
Synonyms 2,3,4-Tri-O-acetyl-N-(4-methylphenyl)-6-O-(2,3,4,6-tetra-O-acetylhexopyranosyl)hexopyranosylamine [3,4,5-triacetoxy-6-[[3,4,5-triacetoxy-6-(4-methylanilino)tetrahydropyran-2-yl]methoxy]tetrahydropyran-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[[3,4,5-triacetyloxy-6-(4-methylanilino)oxan-2-yl]methoxy]oxan-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[[3,4,5-triacetyloxy-6-[(4-methylphenyl)amino]oxan-2-yl]methoxy]oxan-2-yl]methyl ethanoate Acetic acid [3,4,5-triacetyloxy-6-[[3,4,5-triacetyloxy-6-(4-methylanilino)-2-oxanyl]methoxy]-2-oxanyl]methyl ester
Wiley ID 1415773