ピーク情報

リーフレタスグリーン

pos

Peak #7964 MN MID: SE198_S12_M90

m/z: 571.16021, RT: 47.80, 強度: 39407, ログ強度: 1.10, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (22 names) Isonigerone;Chamaejasmenin D;(+)-Chamaejasmenin D;Licobichalcone;rel- [(1R,2R)-1-(3,4-Dihydroxy-2-methoxyphenyl)-1,2-dihydro-6,7-dihydroxy-8-methoxy-1,2-naphthalenediyl]bis[(4-hydroxyphenyl)methanone;...

DBごとのヒット数: ALL 17 KN 13 HM 4

FlavonoidSearch最大スコア MS2: -, MS3: 0.065

安定同位体ラベル実験で見積もられた原子数:

N: 2

S: 1

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
C32H26O10	570.15260	0.582	Isonigerone	HMDB: HMDB0033498
C32H26O10	570.15260	0.582	Chamaejasmenin D	KNApSAcK: C00031675 LipidMAPS: LMPK12040011
C32H26O10	570.15260	0.582	Licobichalcone	KNApSAcK: C00014525
C32H26O10	570.15260	0.582	(I-2S,II-2S)-I-7,II-7-Di-O-methyltetrahydroamentoflavone	KNApSAcK: C00014686
C32H26O10	570.15260	0.582	Fonsecinone A	KNApSAcK: C00034519
C32H26O10	570.15260	0.582	Asperpyrone C	KNApSAcK: C00044552
C32H26O10	570.15260	0.582	7,7''Di-O-methyl-2,3,2'',3''-tetrahydroochnaflavone	KNApSAcK: C00014727
C32H26O10	570.15260	0.582	Nigerone	HMDB: HMDB0033496
C32H26O10	570.15260	0.582	Chamaejasmenin A	KNApSAcK: C00006427, C00006428, C00031893
C32H26O10	570.15260	0.582	Isoaurasperone A	HMDB: HMDB0033489
C32H26O10	570.15260	0.582	Floribundiquinone D	KNApSAcK: C00030281
C32H26O10	570.15260	0.582	Presengulone	KNApSAcK: C00044286
C32H26O10	570.15260	0.582	4,4',6,6'-Tetramethoxy-[1,1'-biphenanthrene]-2,2',3,3',7,7'-hexol	KNApSAcK: C00043201
C32H26O10	570.15260	0.582	7,7''-Di-O-Methyltetrahydrohinokiflavone	KNApSAcK: C00014720
C32H26O10	570.15260	0.582	Aurasperone A	HMDB: HMDB0033929 KNApSAcK: C00034441
C32H26O10	570.15260	0.582	Floribundiquinone A	KNApSAcK: C00030278, C00030279
C25H26O8N6S	570.15328	-0.621	Fuzlocillin	HMDB: HMDB0252537

MSnスペクトル情報

Level: 2, プリカーサーm/z: 571.16003

Splash: splash10-0006-0000900000-9fd698865636d0f91892

m/z	Int.	NL	Rel.Int.
491.27	21117	80	1000

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Geranyl)-B(2OH)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artoindonesianin A
0.000	[CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone]-A(2OH, 1(5-Hydroxy-9-methyl-8-oxa-tricyclo[7.3.1.0(2,7)]trideca-2(7),3,5,10-tetraen-11-yl))-B(1OH)	CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone	Sanggenon B

Level: 3, プリカーサーm/z: 491.24115

Splash: splash10-00di-0179400000-070dedda91721393f74e

m/z	Int.	NL	Rel.Int.
241.07	3230	250	1000
370.15	2942	121	910
474.15	1667	17	516
223.07	1480	268	458
352.26	975	139	301
197.09	786	294	243
326.12	678	165	209
473.48	674	18	208
388.27	604	103	187
324.16	572	167	176
342.19	509	149	157
405.30	456	86	141
445.19	433	46	134
296.20	397	195	122
456.29	371	35	115
213.12	232	278	71
387.37	208	104	64

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.065	[Flavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavone	Dorsilurin A
0.063	[Isoflavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Isoflavone	Euchrenone b2
0.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OMe)	Flavone	Isoorientin 7,3',4'-trimethyl ether
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1(1-(2-Hydroxy-5-methoxycarbonylphenyl)-3-methylbut-2-enyl))-B(none)	Dihydrochalcone	Piperaduncin A
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1(6-Ethyl-4-hydroxy-5-methyl-2-oxo-2H-pyran-3-yl))-B(none)	Flavanone	8-Prenyllepidissipyrone
0.000	[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Amorinin
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1(C-Prenyl))	Flavanone	Amoridin
0.000	[Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))	Flavanone	Tanariflavanone B
0.000	[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a6
0.000	[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-acetate
0.000	[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-acetate
0.000	[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-acetate
0.000	[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 6''-O-acetate
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH, 2(C-Prenyl))-B(2OH)	3-substituted Flavone	Artelasticin
0.000	[3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH)	3-substituted Flavone	Rubraflavone C
0.000	[3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH)	3-substituted Flavone	Artocommunol CD
0.000	[Flavone]-A(2OH, 1Farnesyl)-B(2OH)	Flavone	Moralbanone
0.000	[UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone ([2,3:4,3]-(6,6-Dimethyldihydropyrano))]-A(2([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone	Dorsilurin E
0.000	[Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Isoflavone	Orobol 6-C-(6''-acetylglucoside)
0.000	[Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Isoflavone	Orobol 8-C-(6''-acetylglucoside)