ピーク情報

シロイヌナズナ　地上部

pos

Peak #12507 MN MID: SE200_S1_M90

m/z: 857.50587, RT: 98.75, 強度: 345099, ログ強度: 1.91, アダクト: [M+IsoProp+Na]+, [M+CH3OH+Na]+, [M+Na]+, [M-H2O+Na]+, [M+CH3OH+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (2 names) 1-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(10-(1'Z,3'Z-hexadienyloxy)-7Z,9E-decadienoyl)-3-O-beta-D-galactosyl-sn-glycerol;Arabidopside A

DBごとのヒット数: ALL 2 KN 1 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
C43H66O12	774.45543	4.785	1-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(10-(1'Z,3'Z-hexadienyloxy)-7Z,9E-decadienoyl)-3-O-beta-D-galactosyl-sn-glycerol	LipidMAPS: LMGL05010043
C43H66O12	774.45543	4.785	Arabidopside A	KNApSAcK: C00042234 LipidMAPS: LMGL05010035

MSnスペクトル情報

Level: 2, プリカーサーm/z: 857.50409

Splash: splash10-00lr-0000090000-62b8284336e7d7244b9a

m/z	Int.	NL	Rel.Int.
533.37	61717	324	1000
565.39	60948	292	987
566.38	19333	291	313
534.35	19315	323	312

Level: 3, プリカーサーm/z: 565.39001

Splash: splash10-001i-0001900000-0698e858e3d024f60ac8

m/z	Int.	NL	Rel.Int.
481.29	12596	84	1000
409.23	3975	156	315
423.24	3241	142	257
403.36	2207	162	175
482.41	2189	83	173
347.23	1988	218	157
313.10	1536	252	121
533.44	1418	32	112
465.40	832	100	66
424.27	707	141	56
451.19	666	114	52
241.08	663	324	52
410.26	638	155	50

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Schaftoside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	Isocorymboside
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Neocorymboside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Xylopyranosyl-8-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Galactopyranosyl-8-C-xylopyranosylapigenin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Isoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoisoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Apiofuranosyl))-B(1OH)	Flavone	6-C-beta-D-Glucopyranosyl-8-C-beta-D-apiofuranosylapigenin
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Corymboside

Level: 3, プリカーサーm/z: 533.36523

Splash: splash10-00xr-0009100000-ff48fe0c22586d654099

m/z	Int.	NL	Rel.Int.
371.29	2567	162	1000
315.31	2165	218	843
372.32	530	161	206
355.34	360	178	140
443.33	341	90	132
464.54	310	69	120
316.31	267	217	104
241.11	235	292	91
459.44	223	74	86
463.47	215	70	83
259.12	178	274	69
413.25	161	120	62
203.08	156	330	60
374.42	136	159	52

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(E)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Isogemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(Z)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Gemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(1OH)	2'-Hydroxychalcone	4-Hydroxyrottlerin
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2'',6''-O-diacetate
[Flavone]-A(1OH, 1OMe, 1(1(O-Acetyl)-C-Glu))-B(2OMe)	Flavone	6''-O-Acetylisoorientin 7,3',4'-trimethyl ether
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 2'',6''-O-diacetate
[Flavone]-A(2OH, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-(2'''-methylbutyrate)

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	FS2	FS3	共有数
	99.21	889.53199	32.0261	2.43	[M+CH3OH+IsoProp-2(H2O)+Na]+, [M+CH3OH-H2O+Na]+, [M+Na]+	(22 names) PA(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(5Z,7Z,10Z,13Z,16Z,19Z)-OH(4)); PA(22:5(4Z,7Z,10Z,13Z,16Z)/22:6(4Z,7Z,10Z,13E,15E,19Z)-OH(17)); PA(22:5(4Z,7Z,10Z,13Z,19Z)-O(16,17)/22:5(4Z,7Z,10Z,13Z,16Z)); PA(22:5(7Z,10Z...	ALL 22 KN 1 HM 21	MS2 MS3 x 2			1
12507	98.75	857.50587	0.0000	1.91	[M+IsoProp+Na]+, [M+CH3OH+Na]+, [M+Na]+, [M-H2O+Na]+, [M+CH3OH+H]+	(2 names) 1-(12-(1'Z,3'Z-hexadienyloxy)-9Z,11E-dodecadienoyl)-2-(10-(1'Z,3'Z-hexadienyloxy)-7Z,9E-decadienoyl)-3-O-beta-D-galactosyl-sn-glycerol; Arabidopside A	ALL 2 KN 1 LM 1	MS2 MS3 x 2			1

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