ピーク情報

トマト Micro-Tom 成熟果実の果肉

pos

Peak #7780 MN MID: SE203_S21_M90

m/z: 579.22034, RT: 55.58, 強度: 4797, ログ強度: 0.20, 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: (5 names) Valtrate hydrine B3;IVHD-valtrate;Isovaleroxyhydroxydihydrovaltrate;Isovaleroxy-hydroxy dihydrovaltrate;Tetrahydroaldosterone-3-glucuronide

DBごとのヒット数: ALL 3 KN 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
C27H40O11	540.25706	0.216	Valtrate hydrine B3	KNApSAcK: C00040618
C27H40O11	540.25706	0.216	IVHD-valtrate	KNApSAcK: C00047463, C00047935
C27H40O11	540.25706	0.216	Tetrahydroaldosterone-3-glucuronide	HMDB: HMDB0010357 LipidMAPS: LMST05010067

MSnスペクトル情報

Level: 2, プリカーサーm/z: 579.21997

Splash: splash10-000i-0000090000-3a11017a7b800e4d5711

m/z	Int.	NL	Rel.Int.
535.38	761	44	1000
561.31	107	18	140
493.34	58	86	76
560.64	54	19	70

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(1(O-p-Coumaroyl)-C-Glu))-B(1OH)	Flavone	Vitexin 2''-O-p-coumarate
[Flavone]-A(1OH, 1OMe, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	6-C-Glucopyranosyl-8-C-arabinopyranosylgenkwanin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Rhamnosyl))-B(1OH)	Flavone	Violanthin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Rhamnosyl))-B(1OH)	Flavone	Isoviolanthin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Chinovosyl))-B(1OH)	Flavone	Violarvensin
[Flavone]-A(2OH, 2(C-Rhamnosyl))-B(2OH)	Flavone	6,8-Di-C-rhamnopyranosylluteolin

Level: 3, プリカーサーm/z: 535.37585

Splash: splash10-0006-0004900000-51a693a1816dc92cc1c0

m/z	Int.	NL	Rel.Int.
493.42	31	42	1000
331.45	6	204	206
382.20	6	153	185
315.16	2	220	72

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-beta-D-Xylopyranosyl-8-C-alpha-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6,8-Di-C-alpha-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6,8-Di-C-beta-D-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6-C-alpha-L-Arabinopyranosyl-8-C-beta-L-arabinopyranosylapigenin
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(1OH)	Flavone	6-C-beta-L-Arabinopyranosyl-8-C-alpha-L-arabinopyranosylapigenin
[Isoflavanone]-A(2OH, 1(C-Glu))-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))	Isoflavanone	Dalpanin

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	FS3	共有数
7780	55.58	579.22034	0.0000	0.20	[M+K]+	(5 names) Valtrate hydrine B3; IVHD-valtrate; Isovaleroxyhydroxydihydrovaltrate; Isovaleroxy-hydroxy dihydrovaltrate; Tetrahydroaldosterone-3-glucuronide	ALL 3 KN 2 LM 1	MS2 MS3		1
	55.55	563.24651	-15.9738	-0.09	[M+Na]+	(5 names) Valtrate hydrine B3; IVHD-valtrate; Isovaleroxyhydroxydihydrovaltrate; Isovaleroxy-hydroxy dihydrovaltrate; Tetrahydroaldosterone-3-glucuronide	ALL 3 KN 2 LM 1	MS2		1
	55.56	558.29121	-20.9291	-0.27	[M+NH4]+	(5 names) Valtrate hydrine B3; IVHD-valtrate; Isovaleroxyhydroxydihydrovaltrate; Isovaleroxy-hydroxy dihydrovaltrate; Tetrahydroaldosterone-3-glucuronide	ALL 3 KN 2 LM 1			4
	55.57	541.26441	-37.9559	0.52	[M+H]+	(5 names) Valtrate hydrine B3; IVHD-valtrate; Isovaleroxyhydroxydihydrovaltrate; Isovaleroxy-hydroxy dihydrovaltrate; Tetrahydroaldosterone-3-glucuronide	ALL 3 KN 2 LM 1			6
	55.57	523.25398	-55.9664	0.89	[M-H2O+H]+	(5 names) Valtrate hydrine B3; IVHD-valtrate; Isovaleroxyhydroxydihydrovaltrate; Isovaleroxy-hydroxy dihydrovaltrate; Tetrahydroaldosterone-3-glucuronide	ALL 3 KN 2 LM 1	MS2 MS3	0.042	6

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