ピーク情報

イネ　玄米　ニッポンバレ

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Peak #3524 MN MID: SE199_S21_M90

m/z: 707.21945, RT: 47.15, 強度: 32251, ログ強度: 1.11, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (12 names) Apigenin 7-rhamnoside-4'-rutinoside;5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside;Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...

DBごとのヒット数: ALL 10 KG 1 KN 4 HM 4 FL 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.091

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
C33H40O18	724.22146	1.758	Apigenin 7-rhamnoside-4'-rutinoside	FlavonoidViewer: FL3FAAGS0033 KNApSAcK: C00004169 LipidMAPS: LMPK12110367
C33H40O18	724.22146	1.758	5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside	KNApSAcK: C00019138
C33H40O18	724.22146	1.758	Ligustroflavone	HMDB: HMDB0254089
C33H40O18	724.22146	1.758	Flavonol 3-O-beta-D-glucosyl-(1->2)-beta-D-glucosyl-(1->2)-beta-D-glucoside	KEGG: C15582
C33H40O18	724.22146	1.758	Melitidin	KNApSAcK: C00047991
C33H40O18	724.22146	1.758	3,3',4'-Trihydroxyflavone 3-O-[a-L-rhamnopyranosyl-(1->2)[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside]	HMDB: HMDB0040307
C33H40O18	724.22146	1.758	Kaempferol 3-rhamnosyl-(1->4)-rhamnoside-7-rhamnoside	FlavonoidViewer: FL5FAAGS0042 KNApSAcK: C00005244 LipidMAPS: LMPK12111878
C33H40O18	724.22146	1.758	Natsudaidain 3-(4-O-3-hydroxy-3-methylglutaroylglucoside)	HMDB: HMDB0040812
C33H40O18	724.22146	1.758	2-Feruloyl-1-sinapoylgentiobiose	HMDB: HMDB0030334
C33H40O18	724.22146	1.758	Apigenin 7-rhamnoside-4'-glucosylrhamnoside	FlavonoidViewer: FL3FAAGS0074

MSnスペクトル情報

Level: 2, プリカーサーm/z: 707.21881

Splash: splash10-052r-0049031000-bb7bf22d9a130f0bb1a1

m/z	Int.	NL	Rel.Int.
339.00	922	368	1000
207.01	820	500	889
369.10	480	338	520
545.15	403	162	437
321.04	237	386	256
583.17	166	124	180
689.17	138	18	150
421.05	128	286	139
670.97	99	36	107
544.47	88	163	95
332.99	65	374	70
391.12	61	316	66
277.02	58	430	62
527.05	57	180	61
547.05	57	160	61
351.06	47	356	51

Level: 3, プリカーサーm/z: 207.00865

Splash: splash10-00di-0900000000-fef059fc820196b3bc50

m/z	Int.	NL	Rel.Int.
174.99	751	32	1000

Level: 3, プリカーサーm/z: 338.99921

Splash: splash10-00b9-0905000000-a6410565ae1d51126f0b

m/z	Int.	NL	Rel.Int.
177.10	469	162	1000
321.06	263	18	560

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.091	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavanone	Citflavanone
0.091	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavanone	Paratocarpin K
0.091	[2'-Hydroxychalcone]-A(3OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Mallotus A
0.071	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	2'-Hydroxychalcone	3,4,2'-Trihydroxy-6'',6''-dimethylpyrano[2'',3'':4',3']chalcone
0.067	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	4-Hydroxyderricin
0.067	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Bavachalcone
0.067	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	2'-Hydroxychalcone	Isoxanthohumol(Helichrysum)
0.067	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	2'-Hydroxychalcone	2',4'-Dihydroxy-6'-methoxy-3'-prenylchalcone
0.063	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(none)	Flavanone	5-Methoxy-7-hydroxy-8-C-prenylflavanone
0.063	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(none)	Flavanone	Tephrinone
0.063	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(none)	Flavanone	5-Hydroxy-7-methoxy-6-C-prenylflavanone
0.063	[Flavanone]-A(1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	4'-Hydroxyisoderricin
0.063	[Flavanone]-A(1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	Bavachinin
0.059	[Flavone]-A(2OH)-B(1OH, 1(C-Prenyl))	Flavone	Yinyanghuo D
0.059	[Flavone]-A(2OH, 1(C-Prenyl))-B(1OH)	Flavone	5,7,4'-Trihydroxy-6-prenylflavone
0.059	[Flavone]-A(2OH, 1(C-Prenyl))-B(1OH)	Flavone	Licoflavone C
0.059	[Chalcone]-A(1OH)-B(1OH, 1OMe, 1(C-Prenyl))	Chalcone	Licochalcone C
0.056	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH)	Isoflavone	Wighteone
0.056	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH)	Isoflavone	Lupiwighteone
0.056	[Isoflavone]-A(2OH)-B(1OH, 1(C-Prenyl))	Isoflavone	Isowighteone
0.043	[Flavonol]-A(2OH, 1(C-Prenyl))-B(none)	Flavonol	3,5,7-Trihydroxy-8-prenylflavone
0.043	[Flavonol]-A(2OH, 1(C-Prenyl))-B(none)	Flavonol	3,5,7-Trihydroxy-6-prenylflavone
0.000	[Pterocarpan]-A(1OH)-B(1OMe, 1(C-Prenyl))	Pterocarpan	Sandwicensin
0.000	[Auronol (2-OMe)]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Auronol	Castillene D
0.000	[Chalcone]-A(1OH)-B(1OH, 1OMe, 1(1,1-Dimethylallyl))	Chalcone	Licochalcone A
0.000	[Chalcone]-A(1OH, 1OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Chalcone	5'-Hydroxy-2'-methoxy-3,4-methylenedioxyfurano[2'',3'':4',3']chalcone
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OMe, 1Oxo, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	beta-Hydroxy(or Oxodihydro)chalcone	Ovalitenone
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	beta-Hydroxy(or Oxodihydro)chalcone	Glyinflanin B
0.000	[Dihydrochalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	Dihydrochalcone	Crotaramin
0.000	[Flavanone]-A(1OMe, 1(2-Hydroxy-1,1-dimethylallyl))-B(none)	Flavanone	Falciformin
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Methyl)-B(none)	Flavanone	6-C-Prenyl-8-C-methylpinocembrin
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Methyl)-B(none)	Flavanone	5,7-Dihydroxy-6-methyl-8-prenylflavanone
0.000	[Flavanone]-A(2OH, 1(4-Oxoprenyl))-B(none)	Flavanone	5,7-Dihydroxy-8-C-(4-oxoprenyl)flavanone
0.000	[Flavonol]-A(2OH, 1(1,1-Dimethylallyl))-B(none)	Flavonol	8-(1,1-Dimethylallyl)galangin
0.000	[Flavan 4-ol]-A(1OMe, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(none)	Flavan 4-ol	Hildgardtol A
0.000	[Flavan 4-ol]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavan 4-ol	Hildgardtol B
0.000	[Flavan]-A(2OMe, 1(C-Prenyl))-B(none)	Flavan	5,7-Dimethoxy-8-prenylflavan
0.000	[CCS-type derivative / [2,3,4:5,4a,4]-(6-Carboxypyrano)anthocyanidin]-A(1OH)-B(1OH)	CCS-type derivative / [2,3,4:5,4a,4]-(6-Carboxypyrano)anthocyanidin	5-Carboxypyranopelargonidin
0.000	[Isoflavone]-A(1OH)-B(1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Isoflavone	Psoralenol
0.000	[Isoflavone]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH)	Isoflavone	6-(1,1-Dimethylallyl)genistein
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Isoflavone	Crotalarin
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavanone	Neotenone
0.000	[Isoflavan]-A(1OH)-B(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavan	2'-O-Methylphaseollinisoflavan
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	Isoflavan	4'-O-Methylglabridin
0.000	[Pterocarpan]-A(1OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpan	Ficinin
0.000	[Pterocarpan]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH)	Pterocarpan	Apiocarpin
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH)	Pterocarpan-6a-ol	Glyceollin III
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Pterocarpan-6a-ol	Glyceollin I
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Pterocarpan-6a-ol	Glyceollin II
0.000	[Pterocarpan-6a-ol]-A(1OH)-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Pterocarpan-6a-ol	Tuberosin
0.000	[2-Phenylbenzofuran]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	2-Phenylbenzofuran	Neoraufurane

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
	47.16	756.27323	49.0538	0.16	[M+CH5N+H]+	(12 names) Apigenin 7-rhamnoside-4'-rutinoside; 5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside; Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...	ALL 10 KG 1 KN 4 HM 4 FL 1			3
	47.12	747.21245	39.9930	0.43	[M+Na]+	(12 names) Apigenin 7-rhamnoside-4'-rutinoside; 5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside; Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...	ALL 10 KG 1 KN 4 HM 4 FL 1	MS2		2
	47.15	742.25639	35.0369	1.61	[M+NH4]+	(12 names) Apigenin 7-rhamnoside-4'-rutinoside; 5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside; Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...	ALL 10 KG 1 KN 4 HM 4 FL 1	MS2		2
	47.14	725.23045	18.0110	0.72	[M+H]+	(12 names) Apigenin 7-rhamnoside-4'-rutinoside; 5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside; Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...	ALL 10 KG 1 KN 4 HM 4 FL 1			3
3524	47.15	707.21945	0.0000	1.11	[M-H2O+H]+	(12 names) Apigenin 7-rhamnoside-4'-rutinoside; 5,7,4'-Trihydroxyisoflavone 7-O-alpha-L-rhamnopyranoside-4'-O-[(alpha-L-rhamnopyranosyl)-(1->2)-beta-D-glucopyranoside; Genistein 7-O-alpha-L-rhamnopyranoside-4'-O-[...	ALL 10 KG 1 KN 4 HM 4 FL 1	MS2 MS3 x 2	0.091	2

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

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