I. M. Novitskiy, T. A. Holt, A. G. Kutateladze, “Structure revision of ent-kaurane diterpenoids, isoserrins A, B, and D, enabled by DU8+ computation of their NMR spectral data”, Mendeleev Commun., 31:3 (2021), 300

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Mendeleev Communications, 2021, Volume 31, Issue 3, Pages 300–301
DOI: https://doi.org/10.1016/j.mencom.2021.04.007 (Mi mendc911)

This article is cited in 1 scientific paper (total in 1 paper)

Communications

Structure revision of ent-kaurane diterpenoids, isoserrins A, B, and D, enabled by DU8+ computation of their NMR spectral data

I. M. Novitskiy, T. A. Holt, A. G. Kutateladze

Department of Chemistry and Biochemistry, University of Denver, Denver, Colorado, USA

Full-text PDF (265 kB) Citations (1) Supplementary materials

DOI: https://doi.org/10.1016/j.mencom.2021.04.007

Graphic abstract: Structure revision of <i>ent</i>-kaurane diterpenoids, isoserrins A, B, and D, enabled by DU8+ computation of their NMR spectral data

Abstract: DU8+ calculations of ¹³C NMR chemical shifts suggested that the structures of isoserrins A, B, and D – which were recently isolated from medicinal plant Isodon serra – are misassigned. Computationally driven structure revisions are presented in this communication.

Keywords: natural products, isoserrins, structure revision, NMR calculations, DU8+.

Bibliographic databases:

Document Type: Article

Language: English

*Supplementary materials:*
		Supplementary_data_1.pdf	(903.5 Kb)

Citation: I. M. Novitskiy, T. A. Holt, A. G. Kutateladze, “Structure revision of ent-kaurane diterpenoids, isoserrins A, B, and D, enabled by DU8+ computation of their NMR spectral data”, Mendeleev Commun., 31:3 (2021), 300–301

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https://www.mathnet.ru/eng/mendc/v31/i3/p300

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