ピーク情報

きく花びら生黄色

pos

Peak #4616 MN MID: SE123_S060581_M90

m/z: 606.26959, RT: 68.87, 強度: 46996, ログ強度: 1.24, アダクト: [M+ACN-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: (15 names) Xylocarpin H;(+)-Xylocarpin H;Malleastrone A;(-)-Malleastrone A;Phenylpyropene A;Xylogranatin O;(-)-Xylogranatin O;Quivisianolide B;(-)-Quivisianolide B;Azelnidipine;Biliverdin-IX-beta;Biliverdin;21H-...

DBごとのヒット数: ALL 11 KG 3 KN 5 HM 3

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
C32H38O10	582.24650	-0.290	Xylocarpin H	KNApSAcK: C00039288, C00040716
C32H38O10	582.24650	-0.290	Malleastrone A	KNApSAcK: C00039717
C32H38O10	582.24650	-0.290	Phenylpyropene A	KNApSAcK: C00015121
C32H38O10	582.24650	-0.290	Xylogranatin O	KNApSAcK: C00048921
C32H38O10	582.24650	-0.290	Quivisianolide B	KNApSAcK: C00035732
C33H34O6N4	582.24783	-2.587	Azelnidipine	HMDB: HMDB0248792
C33H34O6N4	582.24783	-2.587	Biliverdin-IX-beta	KEGG: C21724
C33H34O6N4	582.24783	-2.587	Biliverdin	HMDB: HMDB0001008, [-2]HMDB0304275
C33H34O6N4	582.24783	-2.587	Biliverdin	HMDB: HMDB0245624 KEGG: C00500
C33H34O6N4	582.24783	-2.587	3-O-(1-Benzhydrylazetidin-3-yl) 5-O-propan-2-yl 2-amino-6-methyl-4-(3-nitrophenyl)-3,4-dihydropyridine-3,5-dicarboxylate	HMDB: HMDB0260251
C33H34O6N4	582.24783	-2.587	Biliverdin-IX-delta	KEGG: C21723

MSnスペクトル情報

Level: 2, プリカーサーm/z: 606.26923

Splash: splash10-00a9-0021940000-e341ecf29fbcd1e7d89e

m/z	Int.	NL	Rel.Int.
488.81	557	117	1000
471.29	384	135	688
429.09	244	177	437
530.53	232	76	415
531.29	167	75	300
470.68	122	136	219
360.29	98	246	176
359.25	94	247	168
229.04	91	377	163
588.15	62	18	111
277.13	60	329	108
546.28	60	60	107
270.15	60	336	107
504.52	53	102	95
243.16	49	363	88
505.14	48	101	85
565.17	39	41	69
227.15	37	379	65
211.07	31	395	55
434.45	30	172	53

Level: 3, プリカーサーm/z: 488.80707

Splash: splash10-03e9-0069700000-73c4243311e1f3ff5e4b

m/z	Int.	NL	Rel.Int.
311.29	6	178	1000
411.38	4	77	673
401.26	4	88	626
281.16	4	208	625
384.97	4	104	604
260.21	3	229	552

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(1OH, 1Methyl, 1([2,3:@@]-(4-Isopropyl-6,6,8,8-tetramethyl-5,7-dioxy-4,8-dihydrochromeno)))-B(none)	Flavanone	Lumaflavanone A
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Amorin
[Flavanone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Flemichin A
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a11
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a12
[Flavone]-A(1OH, 1OMe, 1(1(O-Acetyl)-C-Glu))-B(1OH)	Flavone	Isoswertisin 2''-O-acetate
[3-substituted Flavone (3-Geranyl)]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	3-substituted Flavone	Rubraflavone D
[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))	3-substituted Flavone	Sanggenone K
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 2(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Artelastin
[Flavonol]-A(2OH, 2(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavonol	Dorsilurin C

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
	68.88	624.28020	18.0106	0.47	[M+ACN+H]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3			2
4616	68.87	606.26959	0.0000	1.24	[M+ACN-H2O+H]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3	MS2 MS3		2
	68.90	600.28022	-5.9894	0.56	[M+NH4]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3	MS2 MS3		2
	68.88	583.25365	-23.0159	0.27	[M+H]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3			64
	68.87	565.24316	-41.0264	0.68	[M-H2O+H]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3	MS2 MS3	0.118	3
	68.86	547.23246	-59.0371	0.16	[M-2(H2O)+H]+	(15 names) Xylocarpin H; (+)-Xylocarpin H; Malleastrone A; (-)-Malleastrone A; Phenylpyropene A; Xylogranatin O; (-)-Xylogranatin O; Quivisianolide B; (-)-Quivisianolide B; Azelnidipine; Biliverdin-IX-beta; Biliverdin; 21H-...	ALL 11 KG 3 KN 5 HM 3			3

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

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