AtMetExpress Development LC-MS

Perk Nr:adn066414. Quercetin-triHex

Polarity: [NEGATIVE]
Retention time: 2.88
m/z: 787
Annotation: Quercetin-triHex
Annotation level: Characterized
compound:
MS2Ts 8 MS2Ts
KNApSAcK C33H41O22(4):6-Hydroxykaempferol 3,6,7-triglucoside , Herbaceti
C40H37O17(3):C40H36O16+O; C39H34O16+CH3O;
C37H41O19(3):C31H30O14+C6H10O5;
C33H45N2O16S2(3):C33H46N2O17S2-H2O; ,
in-house MS/MS herbacetin-di-O-glucoside(3)
Quercetin 3,4'-diglucoside(1)
Quercetin dihexose(1)
Quercetin 3-O-(Feruloyl)-Triglucoside(1)
Quercetin-3-O-glucoside(1)
Spiraeoside_CE20(1)
Quercetin 3-Sophoroside-7-Glucoside-Caffeoyl(1)
Quercetin 3,4'-Di-Glucoside-3'-(6-Caffeoylglucoside)(1)
qurcetin-3-(caffeoyl)sophoroside-7-glucoside(1)
Quercetin 3-O-(Caffeoyl)Sophoroside-7-O-Glucoside(1)
quercetin-3,7-di-O-glucoside(1)
Herbacetin di-O-glucoside(1)
Herbacetin di-O-glucoside(1)
Quercetin-3,4'-O-di-beta-glucopyranoside_Ramp5-45 V(1)
quercetin-3-O-sophoroside-7-O-glucoside-caffeoyl(1)
quercetin-3-O-sophoroside-7-O-glucoside-caffeoyl(1)
Quercetin 3-Triglucoside-7-Rhamnoside(1)
Quercetin 3-Diglucoside-7-Glucoside -Caffeoyl(1)
Quercetin 3,7-Di-O-Glucoside(1)
Quercetin 3-O-(Caffeoyl)Sophoroside-7-O-Glucoside (Isomer)(1)
Represetative peak This peak

eFP visualizaion


Raw chromatograms


MS2Ts

ATH06n09923

ATH08n13376

ATH14n11815

ATH56n15656

ATH58n16563

ATH59n15816

ATH59n16063

ATH60n16018

Peak intensity data

Sample 1 2 3 4 Average
ATGE_1 0.0075 0.0075 0.0082 0.0057 0.0072
ATGE_7 0.01 0.0073 0.0077 0.0093 0.0086
ATGE_9 0.0063 0.0067 0.0084 0.0069 0.0071
ATGE_10 0.0079 0.0068 0.0061 0.006 0.0067
ATGE_12 0.008 0.0081 0.0092 0.0064 0.0079
ATGE_13 0.006 0.006 0.0078 0.0077 0.0069
ATGE_14 0.0081 0.0109 0.0078 0.0078 0.0086
ATGE_15 0.0088 0.0075 0.0075 0.0074 0.0078
ATGE_16 0.0061 0.0074 0.0072 0.0069 0.0069
ATGE_19 0.0077 0.0082 0.0076 0.0075 0.0077
ATGE_20 0.0082 0.006 0.0128 0.0084 0.0088
ATGE_21 0.0087 0.0085 0.0082 0.0073 0.0082
ATGE_25 0.0058 0.0075 0.0084 0.0086 0.0076
ATGE_26 0.0146 0.0146 0.006 0.0073 0.0106
ATGE_27 0.0072 0.0075 0.0054 0.0085 0.0071
ATGE_28 0.0082 0.0086 0.0058 0.0072 0.0075
ATGE_29 0.0073 0.017 0.0297 0.0065 0.0151
ATGE_32 0.6527 0.6896 0.5861 0.5851 0.6284
ATGE_33 0.3994 0.4902 0.4108 0.5235 0.456
ATGE_39 0.1384 0.1868 0.1807 0.0915 0.1494
ATGE_41 0.0397 0.0519 0.0327 0.0327 0.0392
ATGE_42 0.0561 0.0276 0.0558 0.0452 0.0462
ATGE_45 0.0075 0.0067 0.0252 0.0177 0.0143
ATGE_76 0.0071 0.0099 0.0061 0.0066 0.0074
ATGE_77 0.0074 0.0086 0.0104 0.0231 0.0124
ATGE_78 0.0219 0.0234 0.0073 0.0112 0.0159
ATGE_84 0.0081 0.0078 0.0078 0.0075 0.0078
ATGE_91 0.0079 0.0059 0.0064 0.0074 0.0069
ATGE_92 0.4552 0.3989 0.3012 0.5294 0.4212
ATGE_93 0.0136 0.0136 0.0076 0.007 0.0104
ATGE_95 0.0156 0.0076 0.0096 0.0072 0.01
ATGE_96 0.0055 0.0078 0.0083 0.0079 0.0074
ATGE_97 0.0073 0.0081 0.0082 0.0087 0.0081
ATGE_98 0.0054 0.0103 0.0073 0.0054 0.0071
ATGE_99 0.0075 0.0072 0.0075 0.0076 0.0074
ATGE_101 0.021 0.0069 0.0071 0.0105 0.0114
RIKEN Plant Science Center
Metabolome analysis research team, LC-MS Branch