ピーク情報

しそ葉生

pos

Peak #3164 MN MID: SE113_S060951_M90

m/z: 859.19365, RT: 39.72, 強度: 411038, ログ強度: 2.05, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (4 names) Malonylawobanin;Cyanidin 3-(6''-malonylglucoside-3'-(6'''-caffeylglucoside);Tricin 7-[feruloyl-(->2)-glucuronyl-(1->2)-glucuronide];Cyanidin 3-(6''-caffeylglucoside)-5-(6'''-malonylglucoside)

DBごとのヒット数: ALL 4 KG 1 KN 2 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: -

組成式	分子量	誤差(Δppm）	候補化合物名（代表で最短名を記載）	化合物ID
C39H38O22	858.18547	1.051	Delphinidin 3-(6-(Z)-p-coumaroylglucoside)-5-(6-malonylglucoside)	FlavonoidViewer: [1]FL7AAGGL0023, [1]FL7AAGGL0065 KEGG: [1]C08653 KNApSAcK: [1]C00006886, [1]C00014816 LipidMAPS: [1]LMPK12010299, [1]LMPK12010341
C39H38O22	858.18547	1.051	Cyanidin 3-(6''-malonylglucoside-3'-(6'''-caffeylglucoside)	FlavonoidViewer: [1]FL7AACGL0059 KNApSAcK: [1]C00006830 LipidMAPS: [1]LMPK12010168
C39H38O22	858.18547	1.051	Tricin 7-[feruloyl-(->2)-glucuronyl-(1->2)-glucuronide]	HMDB: HMDB0039906
C39H38O22	858.18547	1.051	Cyanidin 3-(6''-caffeylglucoside)-5-(6'''-malonylglucoside)	FlavonoidViewer: [1]FL7AACGL0054 KNApSAcK: [1]C00006825 LipidMAPS: [1]LMPK12010163

MSnスペクトル情報

Level: 2, プリカーサーm/z: 859.19006

Splash: splash10-01p9-0060098010-c9c9400ba2b63dfd0fad

m/z	Int.	NL	Rel.Int.
535.12	59100	324	1000
611.21	54364	248	919
287.06	44155	572	747
815.09	8292	44	140
491.20	3639	368	61

Level: 3, プリカーサーm/z: 611.11847

Splash: splash10-000i-0090000000-857a1a1ca89a2da37585

m/z	Int.	NL	Rel.Int.
287.16	23806	324	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 2(C-Glu))-B(2OH)	Flavone	Lucenin 2
[Isoflavone]-A(2OH, 2(C-Glu))-B(2OH)	Isoflavone	Orobol 6,8-di-C-glucoside
[Flavone]-A(2OH, 1(1(O-(E)-Caffeoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-(E)-caffeate
[Flavone]-A(2OH, 1(1(O-Caffeoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-caffeate
[Flavone]-A(2OH, 1((O-Caffeoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-caffeate
[Flavone]-A(2OH, 1(1(O-Caffeoyl)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-caffeate

Level: 3, プリカーサーm/z: 535.15790

Splash: splash10-000i-0090100000-77f7e4d795acf8875d22

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-beta-D-Xylopyranosyl-8-C-alpha-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6,8-Di-C-alpha-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6,8-Di-C-beta-D-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6-C-alpha-L-Arabinopyranosyl-8-C-beta-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6-C-beta-L-Arabinopyranosyl-8-C-alpha-L-arabinopyranosylapigenin
[Isoflavanone]-A(2OH, 1(C-Glu))-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))	Isoflavanone	Dalpanin