73485-90-2Relevant articles and documents
Deuterium-induced isotope effects on the 13C chemical shifts of α- D -glucose pentaacetate
Pérez-Hernández, Nury,álvarez-Cisneros, Celina,Cerda-García-Rojas, Carlos M.,Morales-Ríos, Martha S.,Joseph-Nathan, Pedro
, p. 136 - 142 (2013)
1,2,3,4,6-Penta-O-acetyl-α-d-glucopyranose and the corresponding [1-2H], [2-2H], [3-2H], [4-2H], [5-2H], and [6,6-2H2]-labeled compounds were prepared for measuring deuterium/hydrogen-induced effects on 13C chemical shift nΔ (DHIECS) values. A conformational analysis of the nondeuterated compound was achieved using density functional theory (DFT) molecular models that allowed calculation of several structural properties as well as Boltzmann-averaged 13C NMR chemical shifts by using the gauge-including atomic orbital method. It was found that the DFT-calculated C-H bond lengths correlate with 1Δ DHIECS. Copyright
Mono-, Di-, and Tri-C-Deuteration of 1,5-Anhydro-D-glucitol
Funabashi, Masuo,Hasegawa, Toshimori
, p. 2528 - 2531 (2007/10/02)
Deuterium was effectively introduced into the title sugar (1a) at C-1, C-3, C-5, and C-6 to afford 1,5-anhydro-D-,-,-, and -glucitols respectively as primary targets for a basic study of the unknown metabolism of 1a, which had
A SIMPLE SYNTHESIS OF (1R and 1S)--1,5-ANHYDRO-D-GLUCITOL AND -1,5-ANHYDRO-D-GLUCITOL
Funabashi, Masuo,Yoshioka, Shigetake
, p. 677 - 680 (2007/10/02)
As a basic study of metabolism of 1,5-anhydro-D-glucitol, which has recently been identified in both human cerebrospinal fluid and plasma, the title compounds were conveniently synthesized as preliminary targets not only for multideuteration but for triti
