ピーク情報

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Peak #3881 MN MID: SE205_S02_M90

m/z: 457.23352, RT: 41.15, 強度: 6868, ログ強度: 0.31, 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: (2 names) Vindoline;LysoPA(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)

DBごとのヒット数: ALL 2 KG 1 LM 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
C25H32O6N2	456.22604	0.454	Vindoline	HMDB: HMDB0259814 KEGG: C01626 KNApSAcK: C00001784, C00024613
C23H37O7P	456.22769	-3.173	LysoPA(20:5(5Z,8Z,11Z,14Z,17Z)/0:0)	HMDB: HMDB0062308, HMDB0114748 LipidMAPS: LMGP10050033

Level: 2, プリカーサーm/z: 457.23322

Splash: splash10-00di-0940000000-92d3d31f5d1d0834f9e6

m/z	Int.	NL	Rel.Int.
170.02	61679	287	1000
202.10	36315	255	588
171.12	13232	286	214
301.19	6004	156	97
143.98	5280	313	85

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavan 3-ol]-A(2OH)-B(3OH)-C(1(O-Vanilloyl))	Flavan 3-ol	Gallocatechin 3-O-vanillate
[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-1(OMe)-Galloyl))	Flavan 3-ol	Catechin 3-O-(3-O-methylgallate)
[Flavan 3-ol]-A(2OH)-B(2OH)-C(1(O-1(OMe)-Galloyl))	Flavan 3-ol	Catechin 3-O-(4-O-methylgallate)
[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(5-Hydroxy-2-isopropenyl-5-methylhexyl))-B(2OH)	2'-Hydroxychalcone	Kuraridinol
[CCS-type derivative / [beta,2]-(4-(1'-Hydroxy-1'-methylethyl))ethanodihydrochalcone]-A(3OH)-B(1OH, 1OMe, 1(C-Prenyl))	CCS-type derivative / [beta,2]-(4-(1'-Hydroxy-1'-methylethyl))ethanodihydrochalcone	Antiarone J
[Flavanone]-A(2OH, 1(2-(2-hydroxyisopropyl)-5-methyl-4-hexenyl))-B(2OH)	Flavanone	Kushenol Q
[Flavanone]-A(2OH, 1(5-Hydroxy-2-isopropenyl-5-methylhexyl))-B(1OH, 1OMe)	Flavanone	Kushenol P
[Flavonol]-A(2OH, 1(5-Hydroxy-2-isopropenyl-5-methylhexyl))-B(2OH)	Flavonol	Kushenol G
[Isoflavone]-A(2OH, 1(2,3-Dihydroxy-3-methylbutyl))-B(1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))	Isoflavone	Lupinisoflavone M