ピーク情報

リーフレタスグリーン

pos

Peak #11022 MN MID: SE198_S12_M90

m/z: 449.18131, RT: 61.21, 強度: 7014, ログ強度: 0.35, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (13 names) Fluctuanin;Longipilin acetate;Uvedalin;Repandin E;Undulatin;2,3-Epoxyjuanislamin;(4R*,6Z,8R*,10S*,11E)-8-(Acetyloxy)-3-[(acetyloxy)methyl]-2,4,5,8,9,10-hexahydro-10-hydroxy-6,10-dimethyl-2-oxocyclodec...

DBごとのヒット数: ALL 12 KN 11 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: -

安定同位体ラベル実験で見積もられた原子数:

N: 0

S: 0

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
C23H28O9	448.17333	1.558	Fluctuanin	KNApSAcK: C00011880
C23H28O9	448.17333	1.558	Uvedalin	KNApSAcK: C00011832
C23H28O9	448.17333	1.558	Repandin E	KNApSAcK: C00012281
C23H28O9	448.17333	1.558	Undulatin	KNApSAcK: C00010721
C23H28O9	448.17333	1.558	2,3-Epoxyjuanislamin	KNApSAcK: C00035787
C23H28O9	448.17333	1.558	2,3,4,5,2',3',4',6'-Octamethoxychalcone	FlavonoidViewer: FL1CELNS0002 KNApSAcK: C00006992 LipidMAPS: LMPK12120352
C23H28O9	448.17333	1.558	(4R,6Z,8R,10S*,11E)-8-(Acetyloxy)-3-[(acetyloxy)methyl]-2,4,5,8,9,10-hexahydro-10-hydroxy-6,10-dimethyl-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-2-propenoic acid	KNApSAcK: C00012396
C23H28O9	448.17333	1.558	Melcanthin A	KNApSAcK: C00012287
C23H28O9	448.17333	1.558	Dichotosin	FlavonoidViewer: FL6FCBGS0001 KNApSAcK: C00008772 LipidMAPS: LMPK12020272
C23H28O9	448.17333	1.558	Isouvedalin	KNApSAcK: C00011833
C23H28O9	448.17333	1.558	Ethyl [3,4,5-trihydroxy-6-[2-[(4-methoxyphenyl)methyl]phenoxy]oxan-2-yl]methyl carbonate	HMDB: HMDB0250016
C23H28O9	448.17333	1.558	Disyfolide	KNApSAcK: C00012317

MSnスペクトル情報

Level: 2, プリカーサーm/z: 449.18121

Splash: splash10-03di-0090000000-c48f637791486807930e

m/z	Int.	NL	Rel.Int.
263.13	793	186	1000

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(4OMe)-B(1OH, 3OMe)	Flavone	Agehoustin C
[Chalcone]-A(4OMe)-B(4OMe)	Chalcone	2,3,4,5,2',3',4',6'-Octamethoxychalcone
[Anthocyanidin]-A(2OH, 1(C-Glu))-B(2OH)	Anthocyanidin	8-C-Glucosylcyanidin
[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Isoorientin
[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Orientin
[Flavonol]-A(1OH, 1(C-Glu))-B(2OH)	Flavonol	Fisetin 8-C-glucoside
[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	6-C-Glucopyranosylkaempferol
[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	8-C-beta-D-Glucopyranosylkaempferol
[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	6-C-Glucosylorobol
[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	8-C-Glucosylorobol
[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	6-C-Galactosylluteolin
[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	8-C-Galactosylluteolin
[Flavone]-A(3OH, 1(C-Galactosyl))-B(1OH)	Flavone	6-C-Galactosylisoscutellarein
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloartomunin
[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe)	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artomunoxanthone
[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonol E
[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Cycloartomunoxanthone
[UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone	Artonin P
[Flavonol (3-OMe)]-A(4OMe)-B(1OH, 2OMe)	Flavonol	3'-Hydroxy-3,5,6,7,8,4',5'-heptamethoxyflavone
[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(3OMe)	Flavonol	5-Hydroxy-3,6,7,8,3',4',5'-heptamethoxyflavone
[4-Hydroxy-3-phenylcoumarin]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	4-Hydroxy-3-phenylcoumarin	Lonchocarpenin