ピーク情報

シロイヌナズナ　地上部

pos

Peak #9002 MN MID: SE200_S1_M90

m/z: 815.45636, RT: 83.07, 強度: 38541, ログ強度: 0.96, アダクト: [M-H2O+Na]+, 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) Thalictoside I;Goyaglycoside g

DBごとのヒット数: ALL 2 KN 1 HM 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
C43H70O14	810.47656	1.415	Thalictoside I	KNApSAcK: C00032319, C00032320
C43H70O14	810.47656	1.415	Goyaglycoside g	HMDB: HMDB0038350

MSnスペクトル情報

Level: 2, プリカーサーm/z: 815.45654

Splash: splash10-0a4i-0000090000-9429a25b1b1c129f7b05

m/z	Int.	NL	Rel.Int.
505.32	18477	310	1000
551.43	6107	264	330
717.53	1179	98	63
506.37	988	309	53

Level: 3, プリカーサーm/z: 551.34601

Splash: splash10-0udr-0000900000-176120c89c0099024d88

m/z	Int.	NL	Rel.Int.
453.25	1475	98	1000
439.32	1041	112	705
469.37	206	82	139
533.50	128	18	87
389.40	103	162	69
454.57	85	97	57
333.34	75	218	50

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 2(C-Arabinosyl))-B(2OH)	Flavone	6,8-Di-C-Arabinosylluteolin
[Dihydroflavonol]-A(1OH, 1OMe)-B(1OMe)	Dihydroflavonol	Rel-5-hydroxy-7,4'-dimethoxy-2''S-(2,4,5-trimethoxy-E-styryl)-tetrahydrofuro[4''R,5''R:2,3]flavanonol
[Dihydroflavonol]-A(1OH, 1OMe)-B(1OMe)	Dihydroflavonol	Rel-5-Hydroxy-7,4'-dimethoxy-3''S-(2,4,5-trimethoxy-E-styryl)tetrahydrofuro[4''R,5''R:2,3]flavanonol

Level: 3, プリカーサーm/z: 505.32709

Splash: splash10-0006-0089300000-5282fcb387c58d1a24d5

m/z	Int.	NL	Rel.Int.
343.22	657	162	1000
243.11	499	262	758
436.30	227	69	345
287.16	115	218	174
257.05	97	248	147
341.24	83	164	125
313.13	56	192	84
240.92	54	264	82
401.34	51	104	77
437.33	42	68	64
244.20	36	261	54
303.18	36	202	54

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

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MSnスペクトル情報

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