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ALLYL-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-ACETAMIDO-2,6-DIDEOXY-4-METHANESULFONYL-6-THIOCYANATO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 8342XcwkGjz
InChI InChI=1S/C27H38N2O16S2/c1-8-9-37-26-20(29-13(2)30)23(22(45-47(7,35)36)19(43-26)11-46-12-28)44-27-25(41-17(6)34)24(40-16(5)33)21(39-15(4)32)18(42-27)10-38-14(3)31/h8,18-27H,1,9-11H2,2-7H3,(H,29,30)/t18-,19-,20-,21+,22-,23-,24+,25-,26+,27+/m1/s1
InChIKey SDQXHMGTLGUVHL-OBEXHTEASA-N
Mol Weight 710.7 g/mol
Molecular Formula C27H38N2O16S2
Exact Mass 710.166275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 83rCa3k9UMZ
Name ALLYL-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-(1->3)-2-ACETAMIDO-2,6-DIDEOXY-4-METHANESULFONYL-6-THIOCYANATO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H38N2O16S2
InChI InChI=1S/C27H38N2O16S2/c1-8-9-37-26-20(29-13(2)30)23(22(45-47(7,35)36)19(43-26)11-46-12-28)44-27-25(41-17(6)34)24(40-16(5)33)21(39-15(4)32)18(42-27)10-38-14(3)31/h8,18-27H,1,9-11H2,2-7H3,(H,29,30)/t18-,19-,20-,21+,22-,23-,24+,25-,26+,27+/m1/s1
InChIKey SDQXHMGTLGUVHL-OBEXHTEASA-N
Literature Reference Author I.WENZL,N.NEUWIRTH,A.G.HEDENETZ,C.FIEDLER,H.STREICHER,F.M.UN GER,W.SCHMID
Literature Reference Citation MH.CHEM.,133,531(2002)
Literature Reference DOI 10.1007/s007060200026
Molecular Weight 710.723 g/mol
Solvent CDCl3
Source File Reference UWKP11486