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#2;2-[2-[2-[2-(PHOSPHONATO)-ETHOXY]-ETHOXY]-ETHYL-6-O-(2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MANNOPYRANOSYL-PHOSPHONATO)-2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MA

Compound with spectra: 2 NMR

#2;2-[2-[2-[2-(PHOSPHONATO)-ETHOXY]-ETHOXY]-ETHYL-6-O-(2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MANNOPYRANOSYL-PHOSPHONATO)-2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MA
SpectraBase Compound ID DRZrQYV8IH4
InChI InChI=1S/C26H50N2O19P2.3Na/c1-15(30)27-21-19(44-9-7-42-5-3-41-4-6-43-8-10-45-48(36,37)38)12-18(24(33)25(21)34)14-46-49(39,40)47-20-11-17(13-29)23(32)26(35)22(20)28-16(2)31;;;/h17-26,29,32-35H,3-14H2,1-2H3,(H,27,30)(H,28,31)(H,39,40)(H2,36,37,38);;;/q;3*+1/p-3/t17-,18-,19+,20+,21-,22-,23-,24-,25-,26-;;;/m0.../s1
InChIKey OTTJAZMZYQVQFN-RIQUKRAGSA-K
Mol Weight 822.57383184 g/mol
Molecular Formula C26H47N2Na3O19P2
Exact Mass 822.194134 g/mol
Parent InChIKey CUKWHRCNFSYDNL-LHCULYAVSA-K
Enantiomer InChIKey OTTJAZMZYQVQFN-ITAJPYMBSA-K

View Spectrum of #2;2-[2-[2-[2-(PHOSPHONATO)-ETHOXY]-ETHOXY]-ETHYL-6-O-(2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MANNOPYRANOSYL-PHOSPHONATO)-2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MA

31P NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O

View Spectrum of #2;2-[2-[2-[2-(PHOSPHONATO)-ETHOXY]-ETHOXY]-ETHYL-6-O-(2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MANNOPYRANOSYL-PHOSPHONATO)-2-ACETAMIDO-2-DEOXY-5A-CARBA-ALPHA-D-MA

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent D2O
1-(ALPHA)-O-METHYL-2-(N-ACETYL)-GLUCOSEAMINE-6-O-PHOSPHATE-1-(ALPHA)-2-(N-ACETYL)-GLUCOSAMINE
METHYL 6-O-(2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSYLPHOSPHO)-ALPHA-D-MANNOPYRANOSIDE, SODIUM SALT
METHYL 6-O-(2-DEOXY-2-ACETAMIDO-ALPHA-D-GLUCOPYRANOSYLPHOSPHORYL)-ALPHA-D-MANNOPYRANOSIDE, TRIETHYLAMMONIUM SALT
3-[(2R,3S,4R,5R,6R)-3-acetamido-4,5-diacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]propionic acid methyl ester
LIPID-X
METHYL-5-ACETAMIDO-2,6-ANHYDRO-4,8,9-TRI-O-BENZYL-3,5-DIDEOXY-D-ERYTHRO-L-GLUCO-NONONAT
ALLYL-6-O-[7-O-(2-DEOXY-2-ACETAMIDO-BETA-D-GLUCOPYRANOSYL)-L-GLYCERO-ALPHA-D-MANNO-HEPTAPYRANOSYL)]-ALPHA-D-GLUCOPYRANOSIDE
BENZYL-2-ACETAMIDO-2-DEOXY-4-O-BETA-D-GALACTOFURANOSYL-ALPHA-D-GLUCOPYRANOSIDE
5-N-ACETYL-8-AZIDO-8-DEOXY-NEURAMINIC-ACID
2-DEOXY-3-O-HEXANOYL-2-(HEXANOYLAMINO)-2-ALPHA-D-GLUCOPYRANOSYL-4-PHOSPHATE
Title Journal or Book Year
A Strategy for Multivalent Presentation of Carba Analogues fromN. meningitidisA Capsular Polysaccharide European Journal of Organic Chemistry 2014
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