ピーク情報

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Peak #6313 MN MID: SE199_S31_M90

m/z: 549.26963, RT: 61.45, 強度: 21753, ログ強度: 0.78, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (19 names) Scuteselerin;(-)-Scuteselerin;Clerodendrin G;(+)-Clerodendrin G;[7'R(S),9R,10S]-7'-Deoxo-2'-deoxy-9,10-epoxy-9,10-dihydro-4'-hydroxy-7'-(1-hydroxyethyl)verrucarin A;Baccharinoid B 20;Archangelolide;Sc...

DBごとのヒット数: ALL 11 KG 1 KN 10

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
C29H40O10	548.26215	0.376	Scuteselerin	KNApSAcK: C00049298
C29H40O10	548.26215	0.376	[7'R(S),9R,10S]-7'-Deoxo-2'-deoxy-9,10-epoxy-9,10-dihydro-4'-hydroxy-7'-(1-hydroxyethyl)verrucarin A	KNApSAcK: C00012588
C29H40O10	548.26215	0.376	Clerodendrin G	KNApSAcK: C00040924
C29H40O10	548.26215	0.376	Archangelolide	KEGG: C09296 KNApSAcK: C00003214
C29H40O10	548.26215	0.376	Scutalpin E	KNApSAcK: C00041116
C29H40O10	548.26215	0.376	[4'R,7'R(S),8R]-7'-Deoxo-2'-deoxy-4',8-dihydroxy-7'-(1-hydroxyethyl)verrucarin A	KNApSAcK: C00012582, C00012584
C29H40O10	548.26215	0.376	[7'R(R)]-7'-Deoxo-16-hydroxy-7'-(1-hydroxyethyl)verrucarin A	KNApSAcK: C00012594
C29H40O10	548.26215	0.376	[2'R,7'R(R),8R]-7'-Deoxo-8-hydroxy-7'-(1-hydroxyethyl)verrucarin A	KNApSAcK: C00012583, C00012585
C29H40O10	548.26215	0.376	[7'R(R)]-2'-Deoxy-7'-deoxo-4',16-dihydroxy-7'-(1-hydroxyethyl)verrucarin A	KNApSAcK: C00012593
C29H40O10	548.26215	0.376	15beta-Hydroxycalactin	KNApSAcK: C00041246, C00042053 LipidMAPS: LMST01120048, LMST01120049
C29H40O10	548.26215	0.376	Areptin B	KNApSAcK: C00040877

MSnスペクトル情報

Level: 2, プリカーサーm/z: 549.26978

Splash: splash10-0udi-0019020000-ec73d596e22a83d919ac

m/z	Int.	NL	Rel.Int.
301.23	2548	248	1000
517.33	550	32	215
283.20	461	266	181
531.17	170	18	66

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(2OH)	2'-Hydroxychalcone	3,4-Dihydroxyrottlerin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(none)	Flavone	Chrysin 6-C-glucoside-8-C-alpha-L-arabinopyranoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(none)	Flavone	Chrysin 6-C-alpha-L-arabinopyranoside-8-C-glucoside
[Flavone]-A(1OH, 1OMe, 2(C-Arabinosyl))-B(1OH)	Flavone	Almeidein
[4-substituted Flavan (4-(1-dodecanoyl-2,4,6-trihydroxyphenyl))]-A(1OH)-B(1OH)	4-substituted Flavan	Myristinin A

ピーク情報

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MSnスペクトル情報

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