ピーク情報

シロイヌナズナ　地上部

pos

Peak #11415 MN MID: SE200_S1_M90

m/z: 797.44804, RT: 93.86, 強度: 74139, ログ強度: 1.24, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 4

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	4.382	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	4.382	Arabidopside A	KNApSAcK: C00042234 LipidMAPS: LMGL05010035

MSnスペクトル情報

Level: 2, プリカーサーm/z: 797.44659

Splash: splash10-0a59-0000090000-bb0871b9e9ef82c05706

m/z	Int.	NL	Rel.Int.
505.36	45432	292	1000
533.37	23035	264	507
506.32	10736	291	236
534.42	6269	263	137

Level: 3, プリカーサーm/z: 505.35645

Splash: splash10-0006-0019000000-0e9f6528617c15c5ffc4

m/z	Int.	NL	Rel.Int.
343.23	4517	162	1000
408.28	456	97	100
391.24	371	114	82
303.14	353	202	78
203.14	334	302	73
287.19	315	218	69
243.11	275	262	60
367.25	255	138	56
240.98	241	264	53

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	Amoricin
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(1OH, 1OMe)	Flavone	Scoparin 6''-O-acetate
[3-substituted Flavone (3-C-Prenyl)]-A(1OH, 1OMe, 1Geranyl)-B(2OH)	3-substituted Flavone	Brosimone H
[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OH)	Flavone	Heterophyllin
[CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone	Artocommunol CC
[CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone	Sanggenon L
[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein D
[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein E
[Flavonol]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavonol	Broussoflavonol D
[Flavonol]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavonol	Poinsettifolin A
[Flavonol]-A(1OH, 1Geranyl, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavonol	Dorsmanin C
[Coumaranochromon]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Coumaranochromon	Euchretin C

Level: 3, プリカーサーm/z: 533.37677

Splash: splash10-00xr-0009100000-9a23240b76f1087e6f9a

m/z	Int.	NL	Rel.Int.
371.31	897	162	1000
315.24	696	218	776
463.37	175	70	195
443.46	100	90	111
372.37	88	161	97
258.99	73	274	81
465.13	66	68	73
355.49	49	178	54
515.36	47	18	52
243.01	45	290	50

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
11415	93.86	797.44804	0.0000	1.24	[M+Na]+	(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			4
	93.84	792.49227	-4.9558	1.27	[M+NH4]+	(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				4

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MSnスペクトル情報

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