For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-4-(AMINOSULFONYL)-BENZYL-S-(2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GALACTOPYRANOSYL)-SULFENAMIDE
SpectraBase Compound ID 3Jzm1buD69k
InChI InChI=1S/C21H28N2O11S2/c1-11(24)30-10-17-18(31-12(2)25)19(32-13(3)26)20(33-14(4)27)21(34-17)35-23-9-15-5-7-16(8-6-15)36(22,28)29/h5-8,17-21,23H,9-10H2,1-4H3,(H2,22,28,29)/t17-,18+,19+,20-,21+/m0/s1
InChIKey KQNMOPGQUNRHLO-XIYVOTBMSA-N
Mol Weight 548.58 g/mol
Molecular Formula C21H28N2O11S2
Exact Mass 548.113452 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AZPe9us4YMY
Name N-4-(AMINOSULFONYL)-BENZYL-S-(2,3,4,6-TETRA-O-ACETYL-1-THIO-BETA-D-GALACTOPYRANOSYL)-SULFENAMIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28N2O11S2
InChI InChI=1S/C21H28N2O11S2/c1-11(24)30-10-17-18(31-12(2)25)19(32-13(3)26)20(33-14(4)27)21(34-17)35-23-9-15-5-7-16(8-6-15)36(22,28)29/h5-8,17-21,23H,9-10H2,1-4H3,(H2,22,28,29)/t17-,18+,19+,20-,21+/m0/s1
InChIKey KQNMOPGQUNRHLO-XIYVOTBMSA-N
Literature Reference Author M.LOPEZ,L.F.BORNAGHI,A.INNOCENTI,D.VULLO,S.A.CHARMAN,C.T.SUP URAN,S.A.POULSEN
Literature Reference Citation J.MED.CHEM.,53,2913(2010)
Literature Reference DOI 10.1021/jm901888x
Molecular Weight 548.580 g/mol
Solvent DMSO-D6
Source File Reference UWMZ46602