PMID- 28833875 OWN - NLM STAT- MEDLINE DCOM- 20180306 LR - 20240109 IS - 1096-9888 (Electronic) IS - 1076-5174 (Linking) VI - 52 IP - 12 DP - 2017 Dec TI - Characterization of phenolic compounds in green and red oak-leaf lettuce cultivars by UHPLC-DAD-ESI-QToF/MS using MS(E) scan mode. PG - 873-902 LID - 10.1002/jms.4021 [doi] AB - Lettuce (Lactuca sativa) is one of the most popular leafy vegetables in the world and constitutes a major dietary source of phenolic compounds with health-promoting properties. In particular, the demand for green and red oak-leaf lettuces has considerably increased in the last years but few data on their polyphenol composition are available. Moreover, the usage of analytical edge technology can provide new structural information and allow the identification of unknown polyphenols. In the present study, the phenolic profiles of green and red oak-leaf lettuce cultivars were exhaustively characterized by ultrahigh-performance liquid chromatography (UHPLC) coupled online to diode array detection (DAD), electrospray ionization (ESI), and quadrupole time-of-flight mass spectrometry (QToF/MS), using the MS(E) instrument acquisition mode for recording simultaneously exact masses of precursor and fragment ions. One hundred fifteen phenolic compounds were identified in the acidified hydromethanolic extract of freeze-dried lettuce leaves. Forty-eight of these compounds were tentatively identified for the first time in lettuce, and only 20 of them have been previously reported in oak-leaf lettuce cultivars in literature. Both oak-leaf lettuce cultivars presented similar phenolic composition, except for apigenin-glucuronide and dihydroxybenzoic acid, only detected in the green cultivar; and for luteolin-hydroxymalonylhexoside, an apigenin conjugate with molecular formula C(40) H(54) O(19) (monoisotopic MW = 838.3259 u), cyanidin-3-O-glucoside, cyanidin-3-O-(3''-O-malonyl)glucoside, cyanidin-3-O-(6''-O-malonyl)glucoside, and cyanidin-3-O-(6''-O-acetyl)glucoside, only found in the red cultivar. The UHPLC-DAD-ESI-QToF/MS(E) approach demonstrated to be a useful tool for the characterization of phenolic compounds in complex plant matrices. CI - Copyright (c) 2017 John Wiley & Sons, Ltd. FAU - Viacava, Gabriela E AU - Viacava GE AD - Grupo de Investigacion en Ingenieria en Alimentos, CONICET, Departamento de Ingenieria Quimica y en Alimentos, Facultad de Ingenieria, Universidad Nacional de Mar del Plata, Juan B. Justo 4302, 7600, Mar del Plata, Argentina. FAU - Roura, Sara I AU - Roura SI AD - Grupo de Investigacion en Ingenieria en Alimentos, CONICET, Departamento de Ingenieria Quimica y en Alimentos, Facultad de Ingenieria, Universidad Nacional de Mar del Plata, Juan B. Justo 4302, 7600, Mar del Plata, Argentina. FAU - Berrueta, Luis A AU - Berrueta LA AD - Grupo de Investigacion de Quimica Analitica de Productos Naturales, Departamento de Quimica Analitica, Facultad de Ciencia y Tecnologia, Universidad del Pais Vasco/Euskal Herriko Unibertsitatea (UPV/EHU), P.O. Box 644, 48080, Bilbao, Spain. FAU - Iriondo, Carmen AU - Iriondo C AD - Grupo de Investigacion de Quimica Analitica de Productos Naturales, Departamento de Quimica Analitica, Facultad de Ciencia y Tecnologia, Universidad del Pais Vasco/Euskal Herriko Unibertsitatea (UPV/EHU), P.O. Box 644, 48080, Bilbao, Spain. FAU - Gallo, Blanca AU - Gallo B AD - Grupo de Investigacion de Quimica Analitica de Productos Naturales, Departamento de Quimica Analitica, Facultad de Ciencia y Tecnologia, Universidad del Pais Vasco/Euskal Herriko Unibertsitatea (UPV/EHU), P.O. Box 644, 48080, Bilbao, Spain. FAU - Alonso-Salces, Rosa M AU - Alonso-Salces RM AUID- ORCID: 0000-0003-2096-4125 AD - Departamento de Biologia, CONICET, Facultad de Ciencias Exactas y Naturales, Universidad Nacional de Mar del Plata, Funes 3350, 7600, Mar del Plata, Argentina. LA - eng PT - Journal Article PL - England TA - J Mass Spectrom JT - Journal of mass spectrometry : JMS JID - 9504818 RN - 0 (Glucosides) RN - 0 (Phenols) RN - 0 (Plant Extracts) RN - 7V515PI7F6 (Apigenin) RN - KUX1ZNC9J2 (Luteolin) SB - IM MH - Apigenin/chemistry MH - Chromatography, High Pressure Liquid/methods MH - Glucosides/chemistry MH - Lactuca/*chemistry MH - Luteolin/chemistry MH - Molecular Structure MH - Phenols/*analysis/chemistry MH - Plant Extracts/chemistry MH - Plant Leaves/*chemistry MH - Spectrometry, Mass, Electrospray Ionization OTO - NOTNLM OT - Lactuca sativa OT - anthocyanin OT - coumarin OT - lignan OT - mass spectrometry OT - polyphenol EDAT- 2017/08/24 06:00 MHDA- 2018/03/07 06:00 CRDT- 2017/08/24 06:00 PHST- 2017/04/24 00:00 [received] PHST- 2017/07/20 00:00 [revised] PHST- 2017/08/17 00:00 [accepted] PHST- 2017/08/24 06:00 [pubmed] PHST- 2018/03/07 06:00 [medline] PHST- 2017/08/24 06:00 [entrez] AID - 10.1002/jms.4021 [doi] PST - ppublish SO - J Mass Spectrom. 2017 Dec;52(12):873-902. doi: 10.1002/jms.4021.