ピーク情報

たけのこ若茎ゆで

pos

Peak #3227 MN MID: SE117_S061501_M90

m/z: 429.24812, RT: 88.34, 強度: 10609, ログ強度: 0.63, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (10 names) Lyoniol D;Dendronpholide I;(-)-Dendronpholide I;Rhodomollein III;Rhodomollein XVI;(+)-Rhodomollein XVI;Dendronpholide J;(-)-Dendronpholide J;Nummularine F;Lotrafiban

DBごとのヒット数: ALL 7 KG 1 KN 5 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
C22H36O8	428.24102	-0.416	Lyoniol D	KNApSAcK: C00051369
C22H36O8	428.24102	-0.416	Dendronpholide I	KNApSAcK: C00038975
C22H36O8	428.24102	-0.416	Rhodomollein III	KNApSAcK: C00042913, C00043869
C22H36O8	428.24102	-0.416	Rhodomollein XVI	KNApSAcK: C00042915
C22H36O8	428.24102	-0.416	Dendronpholide J	KNApSAcK: C00038976
C23H32O4N4	428.24236	-3.539	Nummularine F	KEGG: C10011 KNApSAcK: C00002006
C23H32O4N4	428.24236	-3.539	Lotrafiban	HMDB: HMDB0254173

MSnスペクトル情報

Level: 2, プリカーサーm/z: 429.24759

Splash: splash10-014i-0090000000-4e0d2cca6bbaa2af94a1

m/z	Int.	NL	Rel.Int.
215.09	10779	214	1000
283.16	761	146	70
179.08	654	250	60

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(3OMe)	Flavanone	Heteroflavanone B
[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-<1-Hydroxy-6-oxo-2-cyclohexene-1-carbonyl>))	Flavan 3-ol	Catechin 3-O-(1-hydroxy-6-oxo-2-cyclohexene-1-carboxylate)
[Rotenone]-A(1([2,3:@@]-(5-(1,2-Dihydroxy-1-methylethyl)dihydrofurano)))-B(2OMe)	Rotenone	Amorphigenol
[12a-Hydroxyrotenoid 12-ol]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(2OMe)	12a-Hydroxyrotenoid 12-ol	12-Dihydrodalbinol

Level: 3, プリカーサーm/z: 215.09497

Splash: splash10-01t9-0900000000-80e42e6a49bc22d32c83

m/z	Int.	NL	Rel.Int.
128.88	2744	86	1000
110.95	2227	104	811
100.94	392	114	142
179.07	387	36	140
197.12	360	18	131
68.95	293	146	106

Level: 3, プリカーサーm/z: 283.16162

Splash: splash10-004j-0900000000-7327d6eb95294ed4702f

m/z	Int.	NL	Rel.Int.
197.12	152	86	1000
179.06	137	104	901
128.97	66	154	436
110.80	48	172	316
137.11	16	146	103
133.10	12	150	76
151.08	9	132	61

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OMe)-B(none)	Flavone	7,8-Dimethoxyflavone
[Flavone]-A(2OMe)-B(none)	Flavone	5,6-Dimethoxyflavone
[Flavone]-A(1OMe)-B(1OMe)	Flavone	6,3'-Dimethoxyflavone
[Flavone]-A(2OMe)-B(none)	Flavone	chrysin 5,7-dimethyl ether
[Isoflavone]-A(1OMe)-B(1OMe)	Isoflavone	7,4'-Di-O-methyldaidzein
[Isoflavone]-A(2OMe)-B(none)	Isoflavone	5,7-Dimethoxyisoflavone
[Coumestan]-A(1OH)-B(1OMe)	Coumestan	9-O-Methylcoumestrol
[Aurone]-A(1OH, 1([@@]-Methylenedioxy))-B(none)	Aurone	4,5-Methylenedioxy-6-hydroxyaurone
[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Chalcone]-A(1OH, 3Methyl)-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Chalcone	Ohobanin
[UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone]-A(1([2,3:@@]-(5-Oxotetrahydrofurano)))-B(none)	UBR-type derivative / 2'-Oxo-3'-enyl-0-hydroxy-type Chalcone	Cryptocaryone
[Dihydrochalcone alpha-ol]-A(1OH, 1([2,3:@@]-Furano))-B(none)	Dihydrochalcone alpha-ol	Castillene E
[Flavone]-A(1OH, 1Methyl)-B(1OMe)	Flavone	Saltillin
[Flavone]-A(1OH, 1OMe, 1Methyl)-B(none)	Flavone	6-Methyltectochrysin
[Flavone]-A(2OH, 2Methyl)-B(none)	Flavone	Matteuorien
[Flavonol (3-OMe)]-A(1OMe)-B(none)	Flavonol	3,7-Dimethoxyflavone
[Isoflavone]-A(1OH)-B(1OH, 1Formyl)	Isoflavone	Corylinal
[Isoflavone]-A(1OH)-B(1([@@]-Methylenedioxy))	Isoflavone	Pseudobaptigenin
[Pterocarpene]-A(1OMe)-B(1OMe)	Pterocarpene	Anhydrovariabilin
[Pterocarpene]-A(1OH)-B(1([@@]-Methylenedioxy))	Pterocarpene	3-Hydroxy-8,9-methylenedioxypterocarp-6a-ene
[Coumestan]-A(1Methyl)-B(2OH)	Coumestan	8,9-Dihydroxy-1-methylcoumestan
[4-phenylcoumarin]-A(2OMe)-B(none)	4-phenylcoumarin	Methyldalbergin

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	共有数
	88.38	474.30608	45.0580	0.09	[M+C2H7N+H]+	(10 names) Lyoniol D; Dendronpholide I; (-)-Dendronpholide I; Rhodomollein III; Rhodomollein XVI; (+)-Rhodomollein XVI; Dendronpholide J; (-)-Dendronpholide J; Nummularine F; Lotrafiban	ALL 7 KG 1 KN 5 HM 1	MS2	1
	88.34	460.29036	31.0422	0.09	[M+CH5N+H]+	(10 names) Lyoniol D; Dendronpholide I; (-)-Dendronpholide I; Rhodomollein III; Rhodomollein XVI; (+)-Rhodomollein XVI; Dendronpholide J; (-)-Dendronpholide J; Nummularine F; Lotrafiban	ALL 7 KG 1 KN 5 HM 1	MS2 MS3	2
	88.34	451.23036	21.9822	0.22	[M+Na]+	(10 names) Lyoniol D; Dendronpholide I; (-)-Dendronpholide I; Rhodomollein III; Rhodomollein XVI; (+)-Rhodomollein XVI; Dendronpholide J; (-)-Dendronpholide J; Nummularine F; Lotrafiban	ALL 7 KG 1 KN 5 HM 1		2
	88.34	446.27477	17.0267	0.93	[M+NH4]+	(10 names) Lyoniol D; Dendronpholide I; (-)-Dendronpholide I; Rhodomollein III; Rhodomollein XVI; (+)-Rhodomollein XVI; Dendronpholide J; (-)-Dendronpholide J; Nummularine F; Lotrafiban	ALL 7 KG 1 KN 5 HM 1	MS2 MS3	3
3227	88.34	429.24812	0.0000	0.63	[M+H]+	(10 names) Lyoniol D; Dendronpholide I; (-)-Dendronpholide I; Rhodomollein III; Rhodomollein XVI; (+)-Rhodomollein XVI; Dendronpholide J; (-)-Dendronpholide J; Nummularine F; Lotrafiban	ALL 7 KG 1 KN 5 HM 1	MS2 MS3 x 2	2