ピーク情報

イヌカタヒバ

pos

Peak #10946 MN MID: SE205_S02_M90

m/z: 523.32694, RT: 95.44, 強度: 577056, ログ強度: 2.24, アダクト: [M+CH3OH+H]+, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (7 names) 14,16-14,21-15,20-triepoxy-14,15-secopregnan-5-en-3-ol 3-O-beta-d-diginopyranoside;Caseamembrin B;(+)-Caseamembrin B;Hemibrevetoxin B;Spongianolide E;Macrocarpal I;Caudatin

DBごとのヒット数: ALL 6 KG 1 KN 3 HM 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
C28H42O7	490.29305	0.809	14,16-14,21-15,20-triepoxy-14,15-secopregnan-5-en-3-ol 3-O-beta-d-diginopyranoside	LipidMAPS: LMST01010403
C28H42O7	490.29305	0.809	Caseamembrin B	KNApSAcK: C00043352
C28H42O7	490.29305	0.809	Hemibrevetoxin B	KEGG: C20016
C28H42O7	490.29305	0.809	Spongianolide E	KNApSAcK: C00040356
C28H42O7	490.29305	0.809	Macrocarpal I	HMDB: HMDB0041587
C28H42O7	490.29305	0.809	Caudatin	HMDB: HMDB0249707 KNApSAcK: C00031659 LipidMAPS: LMST02030262

MSnスペクトル情報

Level: 2, プリカーサーm/z: 523.32611

Splash: splash10-0a4i-0000090000-b27767ef2ccbe3f97d16

m/z	Int.	NL	Rel.Int.
505.32	1883	18	1000

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Lavandulyl)-B(2OH, 1OMe)	Flavanone	Exiguaflavanone D
0.000	[CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone	Carpelastofuran

Level: 3, プリカーサーm/z: 505.31775

Splash: splash10-004i-0900000000-0dfb577f3454e64d60e7

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	Amoricin
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(1OH, 1OMe)	Flavone	Scoparin 6''-O-acetate
[3-substituted Flavone (3-C-Prenyl)]-A(1OH, 1OMe, 1Geranyl)-B(2OH)	3-substituted Flavone	Brosimone H
[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(3OH)	Flavone	Heterophyllin
[CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone	Artocommunol CC
[CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	CCS-type derivative / [3,2']-Epoxy-2-hydroxy-3-prenylflavanone	Sanggenon L
[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein D
[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein E
[Flavonol]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavonol	Broussoflavonol D
[Flavonol]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavonol	Poinsettifolin A
[Flavonol]-A(1OH, 1Geranyl, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	Flavonol	Dorsmanin C
[Coumaranochromon]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Coumaranochromon	Euchretin C

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

関連ピーク情報

m/z	Int.	NL	Rel.Int.
176.97	828	328	1000
144.94	42	360	50