ピーク情報

シロイヌナズナ　地上部

pos

Peak #5455 MN MID: SE200_S1_M90

m/z: 581.16357, RT: 54.38, 強度: 25438, ログ強度: 0.68, アダクト: [M+K]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (3 names) 6-O-(3,4,5-trimethoxybenzoyl)-ajugol;Deoxyloganin tetraacetate;Lucidumoside B

DBごとのヒット数: ALL 3 KG 1 KN 2

FlavonoidSearch最大スコア MS2: -, MS3: 0.115

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
C25H34O13	542.19994	0.876	6-O-(3,4,5-trimethoxybenzoyl)-ajugol	KNApSAcK: C00035510
C25H34O13	542.19994	0.876	Deoxyloganin tetraacetate	KEGG: C11646, C11650 LipidMAPS: LMPR0102070019, LMPR0102070021
C25H34O13	542.19994	0.876	Lucidumoside B	KNApSAcK: C00033127

Level: 2, プリカーサーm/z: 581.16260

Splash: splash10-000i-0000490000-50aa516b75200e70f7df

m/z	Int.	NL	Rel.Int.
537.22	4096	44	1000
493.23	1677	88	409
451.26	471	130	115
563.15	325	18	79
495.24	232	86	56

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(2OH)	Flavone	Lucenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Carlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Isocarlinoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(2OH)	Flavone	Neocarlinoside

Level: 3, プリカーサーm/z: 537.22205

Splash: splash10-0udl-0000900000-86eb9673b02c71dd4ca6

m/z	Int.	NL	Rel.Int.
451.24	885	86	1000
493.35	520	44	587

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Flavone]-A(2OH, 1OMe, 1(C-Glu))-B(3OMe)	Flavone	5,7-Dihydroxy-8,3',4',5'-tetramethoxyflavone 6-C-glucoside
0.000	[Isoflavone]-A(2OH, 1OMe, 1(C-Glu))-B(3OMe)	Isoflavone	Dalpaniculin

Level: 3, プリカーサーm/z: 493.23248

Splash: splash10-0f89-0010900000-181d9933c3d3e57f452c

m/z	Int.	NL	Rel.Int.
433.34	41	60	1000
451.40	14	42	355
404.96	11	88	273
415.43	7	78	180
465.41	7	28	177
241.20	6	252	155
475.48	6	18	137
360.85	5	132	124
209.13	5	284	121
466.41	5	27	118
229.16	4	264	109
269.11	4	224	108
402.97	3	90	68
414.75	2	78	54
317.01	2	176	50

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.115	[Flavanone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavanone	Amorisin
0.115	[Flavanone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavanone	Lespedezaflavanone E
0.050	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 2OMe)	Flavone	Isopyrenin
0.000	[Dihydrochalcone]-A(3OH, 1Geranyl)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Dihydrochalcone	2',4',6',3-Tetrahydroxy-3'-geranyl-6'',6''-dimethylpyrano[2'',3'':4,5]dihydrochalcone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1Geranyl)	Flavanone	Nymphaeol C
0.000	[Flavanone]-A(2OH, 1Farnesyl)-B(2OH)	Flavanone	6-Farnesyl-3',4',5,7-tetrahydroxyflavanone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Lavandulyl)-B(2OH)	Flavanone	Kushenol B
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Geranyl)-B(2OH)	Flavanone	Macrourone C
0.000	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH, 1Geranyl)	Dihydroflavonol	Sanggenol C
0.000	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1Geranyl)	Isoflavanone	Sophoraisoflavanone D