Institut fücr Ionenphysik und Angewandte Physik, Leopold-Franzens Universität Innsbruck, Technikerstrasse 25, A-6020 Innsbruck, Austria.
J Chem Phys. 2022 Aug 21;157(7):074301. doi: 10.1063/5.0101726.
Fluorodeoxyglucose (FDG) is a glucose derivative with fluorine at the C position. The molecule containing the radioactive F-18 isotope is well known from its application in positron emission tomography as a radiotracer in tumor examination. In the stable form with the F-19 isotope, FDG was proposed as a potential radiosensitizer. Since reduction processes may be relevant in radiosensitization, we investigated low-energy electron attachment to FDG with a crossed electron-molecule beam experiment and with quantum chemical calculations as well as molecular dynamics at elevated temperatures to reveal statistical dissociation. We experimentally find that the susceptibility of FDG to low-energy electrons is relatively low. The calculations indicate that upon attachment of an electron with a kinetic energy of ∼0 eV, only dipole-bound states are accessible, which agrees with the weak ion yields observed in the experiment. The temporary negative ions formed upon electron attachment to FDG may decay by a large variety of dissociation reactions. The major fragmentation channels include HO, HF, and H dissociation, accompanied by ring opening.
氟脱氧葡萄糖(FDG)是一种在 C 位带有氟的葡萄糖衍生物。含有放射性 F-18 同位素的分子因其在正电子发射断层扫描(PET)中作为肿瘤检查的示踪剂而广为人知。在具有 F-19 同位素的稳定形式中,FDG 被提议作为一种潜在的放射增敏剂。由于还原过程可能与放射增敏有关,我们通过交叉电子分子束实验以及量子化学计算和高温下的分子动力学研究了 FDG 与低能电子的相互作用,以揭示统计解离。我们的实验发现,FDG 对低能电子的敏感性相对较低。计算表明,当电子的动能约为 0 eV 时,只能获得偶极束缚态,这与实验中观察到的弱离子产率一致。电子与 FDG 结合形成的瞬时负离子可能通过多种解离反应进行衰减。主要的碎裂通道包括 HO、HF 和 H 解离,同时伴随着环的打开。