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METHYL-3-AMINO-3-DEOXY-3-N-(2,3,4,6-TETRA-O-ACETYL-5-THIO-ALPHA-D-MANNOPYRANOSYL)-3,4,6-TRI-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE

View entire compound with spectra: 1 NMR

METHYL-3-AMINO-3-DEOXY-3-N-(2,3,4,6-TETRA-O-ACETYL-5-THIO-ALPHA-D-MANNOPYRANOSYL)-3,4,6-TRI-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE
SpectraBase Compound ID E1zhgmwSmR4
InChI InChI=1S/C27H39NO16S/c1-11(29)37-9-18-21(39-13(3)31)20(23(41-15(5)33)27(36-8)44-18)28-26-25(43-17(7)35)24(42-16(6)34)22(40-14(4)32)19(45-26)10-38-12(2)30/h18-28H,9-10H2,1-8H3/t18-,19-,20-,21-,22-,23+,24+,25+,26+,27+/m1/s1
InChIKey VWYLBRIVQSWVCW-IJDBTJOBSA-N
Mol Weight 665.7 g/mol
Molecular Formula C27H39NO16S
Exact Mass 665.198955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EBSzzRs10V7
Name METHYL-3-AMINO-3-DEOXY-3-N-(2,3,4,6-TETRA-O-ACETYL-5-THIO-ALPHA-D-MANNOPYRANOSYL)-3,4,6-TRI-O-ACETYL-ALPHA-D-MANNOPYRANOSIDE
Compound Number 8-
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H39NO16S
InChI InChI=1S/C27H39NO16S/c1-11(29)37-9-18-21(39-13(3)31)20(23(41-15(5)33)27(36-8)44-18)28-26-25(43-17(7)35)24(42-16(6)34)22(40-14(4)32)19(45-26)10-38-12(2)30/h18-28H,9-10H2,1-8H3/t18-,19-,20-,21-,22-,23+,24+,25+,26+,27+/m1/s1
InChIKey VWYLBRIVQSWVCW-IJDBTJOBSA-N
Literature Reference Author B.D.JOHNSTON,B.M.PINTO
Literature Reference Citation J.ORG.CHEM.,63,5797(1998)
Literature Reference DOI 10.1021/jo980168r
Molecular Weight 665.664 g/mol
Sample ID 28629
Solvent CDCl3