1H NMR-MS-based heterocovariance as a drug discovery tool for fishing bioactive compounds out of a complex mixture of structural analogues

Ulrike Grienke; Paul A Foster; Julia Zwirchmayr; Ammar Tahir; Judith M Rollinger; Emmanuel Mikros

doi:10.1038/s41598-019-47434-8

1H NMR-MS-based heterocovariance as a drug discovery tool for fishing bioactive compounds out of a complex mixture of structural analogues

Ulrike Grienke (Corresponding author)
, Paul A Foster
, Julia Zwirchmayr
, Ammar Tahir
, Judith M Rollinger
, Emmanuel Mikros

Publications: Contribution to journal › Article › Peer Reviewed

Original language	English
Article number	11113
Pages (from-to)	11113
Number of pages	10
Journal	Scientific Reports
Volume	9
Issue number	1
DOIs	https://doi.org/10.1038/s41598-019-47434-8
Publication status	Published - 31 Jul 2019

Austrian Fields of Science 2012

104013 Natural product chemistry

Keywords

DEREPLICATION
IDENTIFICATION
METABOLITES
METABOLOMICS
NATURAL-PRODUCTS
NUCLEAR-MAGNETIC-RESONANCE
PATTERN-RECOGNITION
STEROID SULFATASE
STRATEGY
TRITERPENOIDS

Access to Document

10.1038/s41598-019-47434-8Licence: CC BY 4.0

https://phaidra.univie.ac.at/o:1090990Licence: CC BY 4.0

Cite this

@article{3eb8caa01e284122888f0e91df35cd59,

title = "1H NMR-MS-based heterocovariance as a drug discovery tool for fishing bioactive compounds out of a complex mixture of structural analogues",

keywords = "DEREPLICATION, IDENTIFICATION, METABOLITES, METABOLOMICS, NATURAL-PRODUCTS, NUCLEAR-MAGNETIC-RESONANCE, PATTERN-RECOGNITION, STEROID SULFATASE, STRATEGY, TRITERPENOIDS",

author = "Ulrike Grienke and Foster, \{Paul A\} and Julia Zwirchmayr and Ammar Tahir and Rollinger, \{Judith M\} and Emmanuel Mikros",

year = "2019",

month = jul,

day = "31",

doi = "10.1038/s41598-019-47434-8",

language = "English",

volume = "9",

pages = "11113",

journal = "Scientific Reports",

issn = "2045-2322",

publisher = "NATURE PUBLISHING GROUP",

number = "1",

}

TY - JOUR

T1 - 1H NMR-MS-based heterocovariance as a drug discovery tool for fishing bioactive compounds out of a complex mixture of structural analogues

AU - Grienke, Ulrike

AU - Foster, Paul A

AU - Zwirchmayr, Julia

AU - Tahir, Ammar

AU - Rollinger, Judith M

AU - Mikros, Emmanuel

PY - 2019/7/31

Y1 - 2019/7/31

KW - DEREPLICATION

KW - IDENTIFICATION

KW - METABOLITES

KW - METABOLOMICS

KW - NATURAL-PRODUCTS

KW - NUCLEAR-MAGNETIC-RESONANCE

KW - PATTERN-RECOGNITION

KW - STEROID SULFATASE

KW - STRATEGY

KW - TRITERPENOIDS

UR - https://www.scopus.com/pages/publications/85070936208

U2 - 10.1038/s41598-019-47434-8

DO - 10.1038/s41598-019-47434-8

M3 - Article

C2 - 31366964

SN - 2045-2322

VL - 9

SP - 11113

JO - Scientific Reports

JF - Scientific Reports

IS - 1

M1 - 11113

ER -

1H NMR-MS-based heterocovariance as a drug discovery tool for fishing bioactive compounds out of a complex mixture of structural analogues

Austrian Fields of Science 2012

Keywords

Access to Document

Other files and links

Fingerprint

Cite this