Search Results - "Wood, Jared S"

DELTA50: A Highly Accurate Database of Experimental 1H and 13C NMR Chemical Shifts Applied to DFT Benchmarking by Cohen, Ryan D., Wood, Jared S., Lam, Yu-Hong, Buevich, Alexei V., Sherer, Edward C., Reibarkh, Mikhail, Williamson, R. Thomas, Martin, Gary E.

“…Density functional theory (DFT) benchmark studies of 1H and 13C NMR chemical shifts often yield differing conclusions, likely due to non-optimal test molecules…”
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Advanced Structure Analysis Reveals a Transient Portimine B Hydrate by Wood, Jared S., Tang, Junchen, Strangman, Wendy K., Williamson, R. Thomas

“…Portimine B was isolated from an extract derived from the dinoflagellate Vulcanodinium rugosum, a known producer of the closely related portimine A. Initial…”
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Cannabicitran: Its unexpected racemic nature and potential origins by Wood, Jared S., Gordon, William H., Morgan, Jeremy B., Williamson, R. Thomas

“…Cannabicitran is a cannabinoid found in levels up to ~10% in commercial “purified” cannabidiol (CBD) extracts. The structure of this natural product was first…”
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Wheldone Revisited: Structure Revision Via DFT-GIAO Chemical Shift Calculations, 1,1-HD-ADEQUATE NMR Spectroscopy, and X‑ray Crystallography Studies by Rangel-Grimaldo, Manuel, Earp, Cody E., Raja, Huzefa A., Wood, Jared S., Mardiana, Lina, Ho, Kin Lok, Longcake, Alexandra, Williamson, R. Thomas, Palatinus, Lukáš, Hall, Michael J., Probert, Michael R., Oberlies, Nicholas H.

“…Wheldone is a fungal metabolite isolated from the coculture of Aspergillus fischeri and Xylaria flabelliformis, displaying cytotoxic activity against breast,…”
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Computationally-Assisted Discovery and Assignment of a New Class of 6/6/5/5 Fused-Ring Diterpene Acting as Pregnane X Receptor Ligands from Isodon serra by Bian, Zhiwei, Liu, Xiaoying, Hu, Shian, Li, Hongyi, Wood, Jared S., Williamson, R. Thomas, Liu, Jiabao, Chen, Ying, Shi, Jin, Cummins, Carolyn L., Ferreira, Daneel, Choo, Yeun-Mun, Wang, Shengpeng, Hamann, Mark T., Wang, Xiaojuan

“…We report here the orchestration of molecular ion networking (MoIN) and a set of computationally assisted structural elucidation approaches in the discovery…”
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Quantitative nuclear magnetic resonance of chloride by an accurate internal standard approach by Wood, Jared S., Dal Poggetto, Guilherme, Wang, Xiao, Reibarkh, Mikhail, Williamson, R. Thomas, Cohen, Ryan D.

“…Chloride is the most common counterion used to improve aqueous solubility and enhance stability of small molecule active pharmaceutical ingredients. While…”
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DELTA50: A Highly Accurate Database of Experimental [sup.1]H and [sup.13]C NMR Chemical Shifts Applied to DFT Benchmarking by Cohen, Ryan D, Wood, Jared S, Lam, Yu-Hong, Buevich, Alexei V, Sherer, Edward C, Reibarkh, Mikhail, Williamson, R. Thomas, Ma

“…Density functional theory (DFT) benchmark studies of [sup.1]H and [sup.13]C NMR chemical shifts often yield differing conclusions, likely due to non-optimal…”
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Calculated and experimental 1H and 13C NMR assignments for cannabicitran by Wood, Jared S., Gordon, William H., Morgan, Jeremy B., Williamson, R. Thomas

“…Cannabicitran is an important cannabinoid natural product produced by Cannabis sativa and is often found at surprisingly high levels (up to ~10%) in “purified”…”
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Calculated and experimental 1 H and 13 C NMR assignments for cannabicitran by Wood, Jared S, Gordon, William H, Morgan, Jeremy B, Williamson, R Thomas

“…Cannabicitran is an important cannabinoid natural product produced by Cannabis sativa and is often found at surprisingly high levels (up to ~10%) in "purified"…”
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DELTA50: A Highly Accurate Database of Experimental 1 H and 13 C NMR Chemical Shifts Applied to DFT Benchmarking by Cohen, Ryan D, Wood, Jared S, Lam, Yu-Hong, Buevich, Alexei V, Sherer, Edward C, Reibarkh, Mikhail, Williamson, R Thomas, Martin, Gary E

“…Density functional theory (DFT) benchmark studies of H and C NMR chemical shifts often yield differing conclusions, likely due to non-optimal test molecules…”
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