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NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**

The NMR spectrum of a mixture of small molecules is a fingerprint of all of its components. Herein, we present an NMR fingerprint method that takes advantage of the fact that fractions contain simplified NMR profiles, with minimal signal overlap, to allow the identification of unique spectral patter...

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Autores principales: Grkovic, Tanja, Pouwer, Rebecca H, Vial, Marie-Laure, Gambini, Luca, Noël, Alba, Hooper, John N A, Wood, Stephen A, Mellick, George D, Quinn, Ronald J
Formato: Online Artículo Texto
Lenguaje:English
Publicado: WILEY-VCH Verlag 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4298794/
https://www.ncbi.nlm.nih.gov/pubmed/24737726
http://dx.doi.org/10.1002/anie.201402239
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author Grkovic, Tanja
Pouwer, Rebecca H
Vial, Marie-Laure
Gambini, Luca
Noël, Alba
Hooper, John N A
Wood, Stephen A
Mellick, George D
Quinn, Ronald J
author_facet Grkovic, Tanja
Pouwer, Rebecca H
Vial, Marie-Laure
Gambini, Luca
Noël, Alba
Hooper, John N A
Wood, Stephen A
Mellick, George D
Quinn, Ronald J
author_sort Grkovic, Tanja
collection PubMed
description The NMR spectrum of a mixture of small molecules is a fingerprint of all of its components. Herein, we present an NMR fingerprint method that takes advantage of the fact that fractions contain simplified NMR profiles, with minimal signal overlap, to allow the identification of unique spectral patterns. The approach is exemplified in the identification of a novel natural product, iotrochotazine A (1), sourced from an Australian marine sponge Iotrochota sp. Compound 1 was used as a chemical probe in a phenotypic assay panel based on human olfactory neurosphere-derived cells (hONS) from idiopathic Parkinson’s disease patients. Compound 1 at 1 μm was not cytotoxic but specifically affected the morphology and cellular distribution of lysosomes and early endosomes.
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spelling pubmed-42987942015-01-27 NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease** Grkovic, Tanja Pouwer, Rebecca H Vial, Marie-Laure Gambini, Luca Noël, Alba Hooper, John N A Wood, Stephen A Mellick, George D Quinn, Ronald J Angew Chem Int Ed Engl Communications The NMR spectrum of a mixture of small molecules is a fingerprint of all of its components. Herein, we present an NMR fingerprint method that takes advantage of the fact that fractions contain simplified NMR profiles, with minimal signal overlap, to allow the identification of unique spectral patterns. The approach is exemplified in the identification of a novel natural product, iotrochotazine A (1), sourced from an Australian marine sponge Iotrochota sp. Compound 1 was used as a chemical probe in a phenotypic assay panel based on human olfactory neurosphere-derived cells (hONS) from idiopathic Parkinson’s disease patients. Compound 1 at 1 μm was not cytotoxic but specifically affected the morphology and cellular distribution of lysosomes and early endosomes. WILEY-VCH Verlag 2014-06-10 2014-04-15 /pmc/articles/PMC4298794/ /pubmed/24737726 http://dx.doi.org/10.1002/anie.201402239 Text en © 2014 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA. This is an open access article under the terms of the Creative Commons Attribution Non-Commercial NoDerivs License, which permits use and distribution in any medium, provided the original work is properly cited, the use is non-commercial and no modifications or adaptations are made. https://creativecommons.org/licenses/by-nc-nd/4.0/ © 2014 The Authors. Published by Wiley-VCH Verlag GmbH & Co. KGaA. This is an open access article under the terms of the Creative Commons Attribution Non-Commercial NoDerivs License, which permits use and distribution in any medium, provided the original work is properly cited, the use is non-commercial and no modifications or adaptations are made.
spellingShingle Communications
Grkovic, Tanja
Pouwer, Rebecca H
Vial, Marie-Laure
Gambini, Luca
Noël, Alba
Hooper, John N A
Wood, Stephen A
Mellick, George D
Quinn, Ronald J
NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title_full NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title_fullStr NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title_full_unstemmed NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title_short NMR Fingerprints of the Drug-like Natural-Product Space Identify Iotrochotazine A: A Chemical Probe to Study Parkinson’s Disease**
title_sort nmr fingerprints of the drug-like natural-product space identify iotrochotazine a: a chemical probe to study parkinson’s disease**
topic Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4298794/
https://www.ncbi.nlm.nih.gov/pubmed/24737726
http://dx.doi.org/10.1002/anie.201402239
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