ピーク情報

シロイヌナズナ　地上部

pos

Peak #10384 MN MID: SE200_S1_M90

m/z: 856.54469, RT: 89.32, 強度: 285681, ログ強度: 1.73, アダクト: [M+CH3OH+CH5N+H]+, [M+2(CH3OH)-2(H2O)+NH4]+, [M+NH4]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (3 names) Stichoposide;Sanguisorbin E;PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))

DBごとのヒット数: ALL 3 HM 2 LM 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
C43H68O13	792.46599	3.795	Stichoposide	HMDB: HMDB0258497
C43H68O13	792.46599	3.795	Sanguisorbin E	HMDB: HMDB0040523

MSnスペクトル情報

Level: 2, プリカーサーm/z: 856.54297

Splash: splash10-01ot-0001049000-51bd1b2e20c56829fd69

m/z	Int.	NL	Rel.Int.
613.40	14761	243	1000
595.38	14008	261	948
645.46	6749	211	457
596.43	4951	260	335
614.43	4432	242	300
627.47	3327	229	225
646.54	2756	210	186
349.26	1892	507	128
631.36	1842	225	124
339.24	1776	517	120
471.40	1493	385	101
275.23	998	581	67
628.43	965	228	65
381.29	851	475	57
321.27	845	535	57

Level: 3, プリカーサーm/z: 595.35474

Splash: splash10-00fr-0052900000-0df877d77e300c00fc3f

m/z	Int.	NL	Rel.Int.
471.36	2705	124	1000
275.21	1410	320	521
349.29	750	246	277
247.17	307	348	113
521.57	231	74	85

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 2(C-Glu))-B(1OH)	Flavone	Vicenin 2
[Isoflavone]-A(2OH, 2(C-Glu))-B(1OH)	Isoflavone	Paniculatin
[UBR-type derivative / 2'-Oxocyclohexa-3',6'-dienyl-type Chalcone]-A(2OH, 1(C-Glu), 1([3,2:m,n]-(Epoxy-C-glucosyl)))-B(1OH)	UBR-type derivative / 2'-Oxocyclohexa-3',6'-dienyl-type Chalcone	Safflor yellow A
[3-substituted Flavone (3-C-Glu)]-A(2OH, 1(C-Glu))-B(1OH)	3-substituted Flavone	3,6-Di-C-glucosylapigenin
[3-substituted Flavone (3-C-Glu)]-A(2OH, 1(C-Glu))-B(1OH)	3-substituted Flavone	3,8-Di-C-glucopyranosylapigenin
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Galactosyl))-B(1OH)	Flavone	6,8-Di-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Galactosyl))-B(1OH)	Flavone	6-C-Glucopyranosyl-8-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(1(O-(E)-p-Coumaroyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-(E)-p-coumarate
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH, 1OMe)	Flavone	6-C-Xylopyranosyl-8-C-glucopyranosylchrysoeriol
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH, 1OMe)	Flavone	6-C-Glucopyranosyl-8-C-xylopyranosylchrysoeriol
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH, 1OMe)	Flavone	Chrysoeriol 6-C-glucoside-8-C-arabinopyranoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH, 1OMe)	Flavone	Chrysoeriol 6-C-arabinopyranoside-8-C-glucoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Rhamnosyl))-B(2OH)	Flavone	Elatin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH, 2OMe)	Flavone	6,8-Di-C-arabinopyranosyltricin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH, 2OMe)	Flavone	6,8-Di-C-arabinopyranosylapometzgerin

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	共有数
10384	89.32	856.54469	0.0000	1.73	[M+CH3OH+CH5N+H]+, [M+2(CH3OH)-2(H2O)+NH4]+, [M+NH4]+	(3 names) Stichoposide; Sanguisorbin E; PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ALL 3 HM 2 LM 1	MS2 MS3	2
	89.33	847.48316	-9.0615	2.37	[M+CH3OH-H2O+Na]+, [M+Na]+	(2 names) Thalictoside I; Goyaglycoside g	ALL 2 KN 1 HM 1	MS2 MS3 x 2	1
	89.32	842.52571	-14.0190	2.61	[M+CH3OH-H2O+NH4]+, [M+NH4]+	(2 names) Thalictoside I; Goyaglycoside g	ALL 2 KN 1 HM 1	MS2	1
	89.32	825.50212	-31.0426	1.54	[M+CH3OH+H]+, [M+H]+	(2 names) Stichoposide; Sanguisorbin E	ALL 2 HM 2		1
	89.32	807.49199	-49.0527	1.49	[M+CH3OH-H2O+H]+, [M+CH3OH+IsoProp+Na]+, [M+H]+	(3 names) Stichoposide; Sanguisorbin E; PA(22:6(4Z,7Z,10Z,13Z,16Z,19Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z))	ALL 3 HM 2 LM 1		1

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

関連ピーク情報