ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #8958 MN MID: SE205_S08_M90

m/z: 583.41487, RT: 93.68, 強度: 12307, ログ強度: 0.49, アダクト: [M-H2O+Na]+, 共有数（同様のピークを含むサンプル数）: 6

DB検索結果: (2 names) buddlenol D;2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol

DBごとのヒット数: ALL 2 HM 2

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
C38H58O4	578.43351	4.670	buddlenol D	HMDB: HMDB0301729, HMDB0304585
C38H58O4	578.43351	4.670	2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol	HMDB: HMDB0012146

Level: 2, プリカーサーm/z: 583.41425

Splash: splash10-014i-0010190000-35de285deb2eed7249d9

m/z	Int.	NL	Rel.Int.
565.37	1731	18	1000
491.44	324	92	186
547.47	283	36	163
375.26	159	208	91
221.01	155	362	89
503.26	115	80	66
403.42	104	180	60
233.17	88	350	50

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(5-Hydroxy-1,7-bis-(4-hydroxyphenyl)-hept-2-enyl))-B(1OH)	2'-Hydroxychalcone	Calyxin B
[Flavanone]-A(1OH, 1OMe, 1(5-Hydroxy-1,7-bis-(4-hydroxyphenyl)-hept-2-enyl))-B(1OH)	Flavanone	Calyxin C
[Flavanone]-A(1OH, 1OMe, 1(2-(4-Hydroxyphenyl)-6-(2-(4-hydroxyphenyl)ethyl)-tetrahydropyran-4-yl))-B(1OH)	Flavanone	Calyxin G
[Flavanone]-A(1OMe, 1([2,3:@@]-(4-(2-Hydroxy-4-(4-hydroxyphenyl)-butyl)-6-(4-hydroxyphenyl)-4,5-dihydropyrano)))-B(1OH)	Flavanone	Calyxin M
[Flavone]-A(2OH, 1(1(O-Vanilloyl)-C-Glu))-B(1OH)	Flavone	2''-O-Vanilloylvitexin
[Flavone]-A(2OH, 1(1(O-p-Methoxybenzoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-p-methoxybenzoate
[4-substituted Flavan 3-ol (4-(2,4,6-Trihydroxyphenyl))]-A(2OH)-B(3OH)-C(1(O-Galloyl))	4-substituted Flavan 3-ol	4-(2,4,6-Trihydroxyphenyl)gallocatechin 3-O-galloate

Level: 3, プリカーサーm/z: 565.36884

Splash: splash10-0002-0035490000-b47d773cc9d216393efa

m/z	Int.	NL	Rel.Int.
547.45	194	18	1000
357.24	32	208	165
507.00	32	58	162
465.23	31	100	159
345.38	26	220	136
387.33	26	178	135
556.34	23	9	117
375.34	23	190	115
425.40	22	140	112
491.60	22	74	111
385.28	21	180	108
277.10	20	288	103
481.32	19	84	96
193.07	18	372	92
203.08	18	362	90
485.42	17	80	88
293.28	17	272	87
221.38	17	344	86
275.02	17	290	86
343.23	16	222	84

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

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
	93.70	601.42551	18.0106	0.33	[M+Na]+	(2 names) buddlenol D; 2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol	ALL 2 HM 2	MS2 MS3			3
8958	93.68	583.41487	0.0000	0.49	[M-H2O+Na]+	(2 names) buddlenol D; 2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinol	ALL 2 HM 2	MS2 MS3			6