首页> 外文期刊>The journal of physical chemistry, B. Condensed matter, materials, surfaces, interfaces & biophysical >Effects of Magnetic Field Cycle on the Polarization Transfer from Parahydrogen to Heteronuclei through Long-Range J-Couplings
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Effects of Magnetic Field Cycle on the Polarization Transfer from Parahydrogen to Heteronuclei through Long-Range J-Couplings

机译:磁场循环对长距离J耦合从对氢极化到杂核极化转移的影响

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摘要

Hyperpolarization of C-13 carboxylate signals of metabolically relevant molecules, such as acetate and pyrirtrate, was recently obtained by means of ParaHydrogen Induced Polarization by Side Arm Hydrogenation (PHIP-SAH). This method relieS on functionalitation of the carboxylic acid with an unsaturated alcohol (side arm), hydrogenation of the unsaturated alcohol using parahydrogen, and polarization transfer to the target C-13 Signal. In this case) parahydrogen protons are added three to four bonds away from the target C-13 nucleus, while biologically televant molecules had been hyperpolarized, using parahydrogen, through hydrogenation of an unsaturated bond adjacent to the target C-13 signal. The herein reported results show that the same polarization level can be obtained on the C-13 carboxylate signal of an ester by means of addition of parahydrogen to the acidic or to the alcoholic moiety and successive application of magnetic field cycle (MFC). Experimental results are supported by calculations that allow one to predict that, upon accurate control of magnetic field strength and speed of the passages, more than 20% polarization can be achieved on the C-13-carboxylate resonance of the esters by means of side arm hydrogenation and MFC.
机译:代谢相关分子(例如乙酸盐和吡ir酸盐)的C-13羧酸盐信号的超极化最近通过侧臂氢化的副氢诱导极化(PHIP-SAH)获得。该方法依赖于用不饱和醇(侧臂)对羧酸进行官能化,使用对氢氢化不饱和醇以及极化转移至目标C-13信号。在这种情况下,对位氢质子被添加到距目标C-13原子核三到四个键的位置,而生物学上的远程分子已经使用对位氢通过氢化邻近目标C-13信号的不饱和键而超极化。本文报道的结果表明,通过将对氢加至酸性或醇部分并连续施加磁场循环(MFC),可以在酯的C-13羧酸酯信号上获得相同的极化能级。实验结果得到了计算的支持,这些计算使人们可以预测,在精确控制磁场强度和通道速度的情况下,借助侧臂可以使酯的C-13-羧酸酯共振达到20%以上的极化氢化和MFC。

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