ピーク情報

はつか大根　葉

pos

Peak #4511 MN MID: SE202_S21_M90

m/z: 387.20168, RT: 39.02, 強度: 4038820, ログ強度: 3.15, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 17

DB検索結果: (17 names) (6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside;2-((1R,2R)-2-((Z)-5-hydroxypent-2-enyl)-3-oxocyclopentyl)acetic acid 5-O-beta-D-glucoside;Sonchuionoside A;(-)-Sonchuionoside A;...

DBごとのヒット数: ALL 13 KN 10 HM 2 LM 1

FlavonoidSearch最大スコア MS2: 0.056, 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
C19H30O8	386.19407	0.865	(6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside	KNApSAcK: C00034988
C19H30O8	386.19407	0.865	2-((1R,2R)-2-((Z)-5-hydroxypent-2-enyl)-3-oxocyclopentyl)acetic acid 5-O-beta-D-glucoside	LipidMAPS: LMFA02020207
C19H30O8	386.19407	0.865	Sonchuionoside C	HMDB: HMDB0035212
C19H30O8	386.19407	0.865	Citroside B	HMDB: HMDB0030370 KNApSAcK: C00029980, C00054961
C19H30O8	386.19407	0.865	Sonchuionoside A	KNApSAcK: C00043017
C19H30O8	386.19407	0.865	Junipeionoloside	KNApSAcK: C00041022
C19H30O8	386.19407	0.865	Apocynoside I	KNApSAcK: C00029703, C00031824
C19H30O8	386.19407	0.865	(6R,9S)-Roseoside	HMDB: HMDB0029772 KNApSAcK: C00029329, C00031467, C00031468, C00032855
C19H30O8	386.19407	0.865	Icariside B1	KNApSAcK: C00031388, C00031825, C00037294
C19H30O8	386.19407	0.865	Staphylionoside A	KNApSAcK: C00031385
C19H30O8	386.19407	0.865	Macarangioside D	KNApSAcK: C00030700
C19H30O8	386.19407	0.865	Icariside B2	KNApSAcK: C00030506, C00033839
C20H26O4N4	386.19541	-2.598	8-(3,4-Dimethoxyphenyl)-7-methyl-1,3-dipropyl-1H-purine-2,6(3H,7H)-dione	HMDB: HMDB0244693

MSnスペクトル情報

Level: 2, プリカーサーm/z: 387.20102

Splash: splash10-0a4i-0192000000-f82026dc635d6b44558a

m/z	Int.	NL	Rel.Int.
207.11	8237	180	1000
225.04	2006	162	243
369.07	1374	18	166
368.40	1201	19	145
189.11	864	198	104
148.94	724	238	87
224.44	685	163	83

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.056	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	Dihydroflavonol	3,5,7,4'-Tetrahydroxy-3'-methoxy-8-prenylflavanone
0.048	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1OMe)	Flavanone	Kushenol V
0.048	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1OMe)	Flavanone	Kushenol W
0.048	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1OMe)	Flavanone	Kenusanone D
0.000	[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(none)	2'-Hydroxychalcone	8-Cinnamoyl-3,4-dihydro-5,7-dihydroxy-4-phenylcoumarin
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(none)	Flavanone	Calomelanol J
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Methylbutadienyl))-B(none)	Flavone	Fulvinervin B
0.000	[Flavone]-A(3OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavone	5,6,7,3'-Tetramethoxy-4',5'-methylenedioxyflavone
0.000	[Flavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(3OMe)	Flavone	5,3',4',5'-Tetramethoxy-6,7-methylenedioxyflavone
0.000	[Flavone]-A(4OMe)-B(1([@@]-Methylenedioxy))	Flavone	Linderoflavone B
0.000	[Flavonol (3-OMe)]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Flavonol	Topazolin hydrate
0.000	[Flavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OMe)	Flavonol	Icaritin
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Melisimplexin
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Meliternin
0.000	[Flavan 3,4-diol (3-OMe)]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 3,4-diol	3,5-Di-O-methyl-8-prenylafzelechin-4beta-ol
0.000	[Flavan 3,4-diol (4-OMe)]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 3,4-diol	4,5-Di-O-methyl-8-prenylafzelechin-4beta-ol
0.000	[Isoflavone]-A(1OH)-B(2OH, 1OMe, 1(3-hydroxy-3-methylbutyl))	Isoflavone	Kwakhurin hydrate
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(3OMe)	Isoflavone	Irisflorentin
0.000	[Isoflavone]-A(4OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	5,6,7,8-Tetramethoxy-3',4'-methylenedioxyisoflavone
0.000	[Isoflavanone-3-ol]-A(1OH)-B(2OH, 1OMe, 1(1,1-Dimethylallyl))	Isoflavanone-3-ol	Secundifloran

Level: 3, プリカーサーm/z: 207.09480

Splash: splash10-01pa-0900000000-c378a9850a66d6aab367

m/z	Int.	NL	Rel.Int.
189.08	166	18	1000
161.14	84	46	508
149.01	76	58	456
165.06	60	42	364
147.17	39	60	233
171.20	20	36	122
163.11	20	44	120
123.02	20	84	119
124.82	19	82	117
175.10	14	32	84
137.14	11	70	69
106.97	10	100	60

Level: 3, プリカーサーm/z: 225.05319

Splash: splash10-004i-0900000000-20dbef32f1335d1b0d97

m/z	Int.	NL	Rel.Int.
175.01	8	50	1000
163.97	3	61	349

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Chalcone]-A(1OH)-B(none)	Chalcone	4'-Hydroxychalcone

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	FS2	FS3	共有数
	38.98	432.25973	45.0581	1.76	[M+C2H7N+H]+	(17 names) (6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside; 2-((1R,2R)-2-((Z)-5-hydroxypent-2-enyl)-3-oxocyclopentyl)acetic acid 5-O-beta-D-glucoside; Sonchuionoside A; (-)-Sonchuionoside A; ...	ALL 13 KN 10 HM 2 LM 1	MS2 MS3 x 2			11
4511	39.02	387.20168	0.0000	3.15	[M+H]+	(17 names) (6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside; 2-((1R,2R)-2-((Z)-5-hydroxypent-2-enyl)-3-oxocyclopentyl)acetic acid 5-O-beta-D-glucoside; Sonchuionoside A; (-)-Sonchuionoside A; ...	ALL 13 KN 10 HM 2 LM 1	MS2 MS3 x 2	0.056		17
	38.76	369.19116	-18.0105	1.46	[M-H2O+H]+	(17 names) (6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside; 2-((1R,2R)-2-((Z)-5-hydroxypent-2-enyl)-3-oxocyclopentyl)acetic acid 5-O-beta-D-glucoside; Sonchuionoside A; (-)-Sonchuionoside A; ...	ALL 13 KN 10 HM 2 LM 1	MS2 MS3 x 2	0.188	0.208	8