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DESULFO-(R)-2-HYDROXY-2-(4-HYDROXYPHENYL)-ETHYLGLUCOSINOLATE;DESULFO-PARA-HYDROXYGLUCOSIBARIN
SpectraBase Compound ID 88EGXohFd8x
InChI InChI=1S/C15H21NO8S/c17-6-10-12(20)13(21)14(22)15(24-10)25-11(16-23)5-9(19)7-1-3-8(18)4-2-7/h1-4,9-10,12-15,17-23H,5-6H2/b16-11+/t9-,10+,12+,13-,14+,15-/m1/s1
InChIKey NGBUVHPKIVDZQW-MZEZEEOTSA-N
Mol Weight 375.39 g/mol
Molecular Formula C15H21NO8S
Exact Mass 375.098788 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6KyPNZk6E74
Name DESULFO-(R)-2-HYDROXY-2-(4-HYDROXYPHENYL)-ETHYLGLUCOSINOLATE;DESULFO-PARA-HYDROXYGLUCOSIBARIN
Compound Number D3R
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H20NO8S
InChI InChI=1S/C15H21NO8S/c17-6-10-12(20)13(21)14(22)15(24-10)25-11(16-23)5-9(19)7-1-3-8(18)4-2-7/h1-4,9-10,12-15,17-23H,5-6H2/b16-11+/t9-,10+,12+,13-,14+,15-/m1/s1
InChIKey NGBUVHPKIVDZQW-MZEZEEOTSA-N
Literature Reference Author N.AGERBIRK,C.E.OLSEN,J.K.NIELSEN
Literature Reference Citation PHYTOCHEM.,58,91(2001)
Literature Reference DOI 10.1016/S0031-9422(01)00151-0
Molecular Weight 374.386 g/mol
Solvent D2O
Source File Reference UWLU2749