Preprint Article Version 1 Preserved in Portico This version is not peer-reviewed

Identification of Fatty Acids, Amides and Cinnamic Derivatives in Supercritical-CO2 Extracts of Cinnamomum tamala Leaves Using UPLC-Q-TOF-MSE Combined with Chemometrics

Version 1 : Received: 12 March 2024 / Approved: 13 March 2024 / Online: 14 March 2024 (07:39:55 CET)

How to cite: Lohani, H.; Kumar, A.; Bidarakundi, V.; Agrawal, L.; Haider, S.Z.; Chauhan, N.K. Identification of Fatty Acids, Amides and Cinnamic Derivatives in Supercritical-CO2 Extracts of Cinnamomum tamala Leaves Using UPLC-Q-TOF-MSE Combined with Chemometrics. Preprints 2024, 2024030797. https://doi.org/10.20944/preprints202403.0797.v1 Lohani, H.; Kumar, A.; Bidarakundi, V.; Agrawal, L.; Haider, S.Z.; Chauhan, N.K. Identification of Fatty Acids, Amides and Cinnamic Derivatives in Supercritical-CO2 Extracts of Cinnamomum tamala Leaves Using UPLC-Q-TOF-MSE Combined with Chemometrics. Preprints 2024, 2024030797. https://doi.org/10.20944/preprints202403.0797.v1

Abstract

Cinnamomum tamala leaf (CTL), also known as tejpat and Indian bay leaf, is used all over the world for seasoning, flavouring, and medicinal purposes. Numerous researchers are interested in exploring the nutritional and medicinal benefits of CTL due to their potential as nutraceuticals. These characteristics could be explained by the presence of several essential bioactive substances and lipid derivatives. There are no reports available on this species about its metabolites profile. In this work, rapid screen and identify chemical compounds in supercritical (SC)-CO2 extracts of CTL by use of UPLC-Q-TOF-MSE with multivariate statistical analysis approach was established in both negative and positive mode. As a results, a total of 166 compounds, including 66 monocarboxylic fatty acids, 52 dicarboxylic fatty acids, 27 fatty acid amides, and 21 others were tentatively identified based on accurate mass, and the mass spectrometric fragmentation pattern, out of which 142 compounds are common and found in all five CTL extracts. They displayed robust [M+H]+ and/or [M-H]- ions in both low- and high-energy collision-induced dissociations (CIDs). Based on chemical profiling and chemometric analysis, CTL4 (300bar/55°C) extract was found significantly more potent in other CTL’s extracts. A new mono- and di-carboxylic fatty acids, fatty acid amides and other essential bioactive compounds were separated within 20 min runtime and identified in CTL for the first time. The combination of UPLC-Q-TOF-MSE and chemometric analysis is a powerful method to rapidly screen the metabolites profile for the quality control of C. tamala leaf.

Keywords

Cinnamomum tamala; chemometrics; fatty acids; fatty acid amides; SC-CO2 extraction; UPLC-Q-TOF-MSE

Subject

Chemistry and Materials Science, Analytical Chemistry

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