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1-THIO-BETA-D-GLUCOPYRANOSE-1-[9-(METHYLSULFONYL)-N-(SULFOXY)-NONANIMIDATE
SpectraBase Compound ID HokJlcAGrQm
InChI InChI=1S/C16H31NO11S3/c1-30(22,23)9-7-5-3-2-4-6-8-12(17-28-31(24,25)26)29-16-15(21)14(20)13(19)11(10-18)27-16/h11,13-16,18-21H,2-10H2,1H3,(H,24,25,26)/p-1/b17-12+/t11-,13-,14+,15-,16+/m0/s1
InChIKey OZKVQSNRAFPWMK-PCIYQOEVSA-M
Mol Weight 508.59 g/mol
Molecular Formula C16H30NO11S3
Exact Mass 508.098099 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FekmXAL4Iku
Name 1-THIO-BETA-D-GLUCOPYRANOSE-1-[9-(METHYLSULFONYL)-N-(SULFOXY)-NONANIMIDATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H30NO11S3
InChI InChI=1S/C16H31NO11S3/c1-30(22,23)9-7-5-3-2-4-6-8-12(17-28-31(24,25)26)29-16-15(21)14(20)13(19)11(10-18)27-16/h11,13-16,18-21H,2-10H2,1H3,(H,24,25,26)/p-1/b17-12+/t11-,13-,14+,15-,16+/m0/s1
InChIKey OZKVQSNRAFPWMK-PCIYQOEVSA-M
Literature Reference Author N.FABRE,M.BON,C.MOULIS,I.FOURASTE,E.STANISLAS
Literature Reference Citation PHYTOCHEM.,45,525(1997)
Literature Reference DOI 10.1016/S0031-9422(96)00765-0
Molecular Weight 508.594 g/mol
Solvent CD3OD
Source File Reference UWSP1414