Fragmentation Patterns of Phenolic C-Glycosides in Mass Spectrometry Analysis

Author:

Du Ting1,Wang Yang1,Xie Huan1ORCID,Liang Dong1ORCID,Gao Song1ORCID

Affiliation:

1. Department of Pharmaceutical Science, College of Pharmacy and Health Sciences, Texas Southern University, 3100 Cleburne Street, Houston, TX 77004, USA

Abstract

Background: Many phenolic C-glycosides possess nutritional benefits and pharmacological efficacies. However, the MS/MS fragmentation pattern of phenolic C-glycosides analysis is understudied. This paper aims to determine the MS/MS fragmentation patterns of phenolic C-glycosides. Method: Ten compounds with different sugar moieties, aglycones, and substitutes were analyzed to determine the impact of these structural features on MS/MS fragmentation using UPLC-QTOF-MS analysis. Results: The results showed that water loss followed by RDA reaction and alpha cleavage in the C-C bonded sugar moieties are the major fragmentation pathways. Additionally, the sugar cleavage was not affected by the skeleton and the substitute of the aglycones. These results suggested that the fragmentation patterns of phenolic C-glycosides differ from those in the O-glycosides, where the O-C glycosidic bond is the most cleavage-liable bond in MS/MS analysis. Conclusions: These MS/MS fragmentation patterns can be used for the identification of C-glycosides from dietary components and herbal medicine as well as developing robust methods using MRM methods to quantify C-glycosides.

Funder

Texas Southern University Innovation

National Institute of Health

National Institute on Minority Health and Health Disparities of the National Institutes of Health

GCC Center for Comprehensive PK/PD and Formulation

National Institute of Minority Health and Health Disparity

Publisher

MDPI AG

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