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NMR Structure Elucidation of Naphthoquinones from Quambalaria cyanescens

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61388971%3A_____%2F21%3A00538938" target="_blank" >RIV/61388971:_____/21:00538938 - isvavai.cz</a>

  • Alternative codes found

    RIV/61388963:_____/21:00538938 RIV/00216208:11310/21:10430105

  • Result on the web

    <a href="https://doi.org/10.1021/acs.jnatprod.0c00930" target="_blank" >https://doi.org/10.1021/acs.jnatprod.0c00930</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1021/acs.jnatprod.0c00930" target="_blank" >10.1021/acs.jnatprod.0c00930</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    NMR Structure Elucidation of Naphthoquinones from Quambalaria cyanescens

  • Original language description

    Naphthoquinones isolated from Quambalaria cyanescens (quambalarines) are natural pigments possessing significant cytotoxic and antimicrobial properties. Determining the structure of naphthoquinone compounds is important for the understanding of their biological activities and the informed synthesis of related analogues. Identifying quambalarines is challenging, because they contain a hydroxylated naphthoquinone scaffold and have limited solubility. Here, we report a detailed structural study of quambalarine derivatives, which form strong intramolecular hydrogen bonds (IMHBs) that enable the formation of several tautomers, these tautomers may complicate structural investigation due to their fast interconversion. To investigate tautomeric equilibria and identify new quambalarines, we complemented the experimental NMR spectroscopy data with density functional theory (DFT) calculations.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database

  • CEP classification

  • OECD FORD branch

    10401 - Organic chemistry

Result continuities

  • Project

    Result was created during the realization of more than one project. More information in the Projects tab.

  • Continuities

    P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Others

  • Publication year

    2021

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Journal of Natural Products

  • ISSN

    0163-3864

  • e-ISSN

    1520-6025

  • Volume of the periodical

    84

  • Issue of the periodical within the volume

    1

  • Country of publishing house

    US - UNITED STATES

  • Number of pages

    10

  • Pages from-to

    46-55

  • UT code for WoS article

    000613247300006

  • EID of the result in the Scopus database

    2-s2.0-85098755178