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3-C-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL)-5-(2-THIENYL)-1,2,4-OXADIAZOLE
SpectraBase Compound ID 6yoA66YZcC0
InChI InChI=1S/C40H30N2O10S/c43-37(25-14-5-1-6-15-25)47-24-29-31(49-38(44)26-16-7-2-8-17-26)32(50-39(45)27-18-9-3-10-19-27)33(51-40(46)28-20-11-4-12-21-28)34(48-29)35-41-36(52-42-35)30-22-13-23-53-30/h1-23,29,31-34H,24H2/t29-,31-,32+,33-,34-/m0/s1
InChIKey NVEDQFOSOMCWAF-XMUXIZPSSA-N
Mol Weight 730.7 g/mol
Molecular Formula C40H30N2O10S
Exact Mass 730.162116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EBhhfLWVHOH
Name 3-C-(2,3,4,6-TETRA-O-BENZOYL-BETA-D-GLUCOPYRANOSYL)-5-(2-THIENYL)-1,2,4-OXADIAZOLE
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H30N2O10S
InChI InChI=1S/C40H30N2O10S/c43-37(25-14-5-1-6-15-25)47-24-29-31(49-38(44)26-16-7-2-8-17-26)32(50-39(45)27-18-9-3-10-19-27)33(51-40(46)28-20-11-4-12-21-28)34(48-29)35-41-36(52-42-35)30-22-13-23-53-30/h1-23,29,31-34H,24H2/t29-,31-,32+,33-,34-/m0/s1
InChIKey NVEDQFOSOMCWAF-XMUXIZPSSA-N
Literature Reference Author M.BENLTIFA,S.VIDAL,B.FENET,M.MSADDEK,P.G.GOEKJIAN,J.P.PRALY, A.BRUNYANSZKI,T.DOCS
Literature Reference Citation EUR.J.ORG.CHEM.,4242(2006)
Molecular Weight 730.746 g/mol
Sample ID 32880
Solvent CDCl3