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PARA-NITROPHENYL 2-ACETAMIDO-2-DEOXY-4-O-(2-ACETAMIDO-2-DEOXY-ALPHA-D-GLUCOPYRANOSYLPHOSPHO)-BETA-D-GLUCOPYRANOSIDE, AMMONIUM SALT
SpectraBase Compound ID BWL1yczn5x4
InChI InChI=1S/C22H32N3O16P.H3N/c1-9(28)23-15-18(31)17(30)13(7-26)38-22(15)41-42(35,36)40-20-14(8-27)39-21(16(19(20)32)24-10(2)29)37-12-5-3-11(4-6-12)25(33)34;/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)(H,35,36);1H3/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-;/m1./s1
InChIKey NVRKZHRVKRYODI-BMJHLPJYSA-N
Mol Weight 642.51 g/mol
Molecular Formula C22H35N4O16P
Exact Mass 642.178568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ImwwPhpR2ob
Name 4-O-(2-DEOXY-2-ACETAMIDO-ALPHA-D-GLUCOPYRANOSYLOXYPHOSPHORYL)-2-DEOXY-2-ACETAMIDO-1-PARA-NITROPHENYL-BETA-D-GLUCOPYRANOSE, AMMONIUM SALT
Comments S=MOS00156
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H35N4O16P
InChI InChI=1S/C22H32N3O16P.H3N/c1-9(28)23-15-18(31)17(30)13(7-26)38-22(15)41-42(35,36)40-20-14(8-27)39-21(16(19(20)32)24-10(2)29)37-12-5-3-11(4-6-12)25(33)34;/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)(H,35,36);1H3/t13-,14-,15-,16-,17-,18-,19-,20-,21-,22-;/m1./s1
InChIKey NVRKZHRVKRYODI-BMJHLPJYSA-N
Instrument Name Bruker AM-300
Literature Reference A.V.NIKOLAEV, I.A.IVANOVA, V.N.SHIBAEV (1990) Bioorganich.Khim.(Russ. Lang.):v.16, N12, 1693-1695.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O