ピーク情報

よもぎ葉生

pos

Peak #10109 MN MID: SE116_S063011_M90

m/z: 405.22705, RT: 90.54, 強度: 35809, ログ強度: 1.07, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (40 names) Kuhistanicaol E;(+)-Kuhistanicaol E;Emblide;(+)-Emblide;Dactylolactone C;(-)-Dactylolactone C;Phellodonic acid;Cortisol 21-acetate;Hydrocortisone acetate;Cortell;4beta,8alpha-Dihydroxy-6alpha-vanilloy...

DBごとのヒット数: ALL 29 KG 2 KN 20 HM 3 LM 4

FlavonoidSearch最大スコア MS2: 0.188, MS3: -

DB検索結果

ppm

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
C23H32O6	404.21989	-0.280	Kuhistanicaol E	KNApSAcK: C00037400
C23H32O6	404.21989	-0.280	Emblide	KNApSAcK: C00041515, C00041851
C23H32O6	404.21989	-0.280	Dactylolactone C	KNApSAcK: C00044686, C00044687
C23H32O6	404.21989	-0.280	Phellodonic acid	KNApSAcK: C00035920
C23H32O6	404.21989	-0.280	Cortisol 21-acetate	HMDB: HMDB0244374 KEGG: C02821 LipidMAPS: LMST02030093
C23H32O6	404.21989	-0.280	Dactylolactone A	KNApSAcK: C00044684, C00044685
C23H32O6	404.21989	-0.280	4beta,8alpha-Dihydroxy-6alpha-vanilloyloxydauc-9-ene	KNApSAcK: C00036567
C23H32O6	404.21989	-0.280	Kuhistanicaol D	KNApSAcK: C00037399
C23H32O6	404.21989	-0.280	Tenuferinin	KNApSAcK: C00020368
C23H32O6	404.21989	-0.280	2,3-Epoxyjaeschkeanadiol 5alpha-vanillate	KNApSAcK: C00021413
C23H32O6	404.21989	-0.280	Desoxycortisone acetate	HMDB: HMDB0251066
C23H32O6	404.21989	-0.280	Strophanthidin	HMDB: HMDB0258516 KEGG: C19988 KNApSAcK: C00032213 LipidMAPS: LMST01120005
C23H32O6	404.21989	-0.280		LipidMAPS: LMPR0104090002
C23H32O6	404.21989	-0.280	Tenuferin	KNApSAcK: C00020367
C23H32O6	404.21989	-0.280	Rubaferinin	KNApSAcK: C00012072
C23H32O6	404.21989	-0.280	Helotialin C	KNApSAcK: C00053299
C23H32O6	404.21989	-0.280	3beta,14,16beta-trihydroxy-19-oxo-5beta-card-20(22)-enolide	LipidMAPS: LMST01120009
C23H32O6	404.21989	-0.280		LipidMAPS: LMPR0103370011
C23H32O6	404.21989	-0.280	Trichodermadienediol B	KNApSAcK: C00012663, C00012667
C23H32O6	404.21989	-0.280	3beta,5beta,10beta,14beta-tetrahydroxy-19-norbufa-20,22-dienolide	LipidMAPS: LMST01130067
C23H32O6	404.21989	-0.280	Caesalpinin MB	KNApSAcK: C00043332
C23H32O6	404.21989	-0.280	o-Methylepoxyshikoccin	KNApSAcK: C00051709
C23H32O6	404.21989	-0.280	Divinatorin D	KNApSAcK: C00047216
C23H32O6	404.21989	-0.280	16-Methyl-epi-nigakihemiacetal B	HMDB: HMDB0039886
C23H32O6	404.21989	-0.280	Memnoconol	KNApSAcK: C00015421
C23H32O6	404.21989	-0.280	1alpha-O-Methylquassin	HMDB: HMDB0039558
C23H32O6	404.21989	-0.280	Methyl 16-acetoxy-17-hydroxyacritoconifert-7-en-oate	KNApSAcK: C00022513
C23H32O6	404.21989	-0.280	8beta-Acetoxy-3beta-angeloyloxy-isocostic acid methyl ester	KNApSAcK: C00022663
C24H28O2N4	404.22123	-3.589	Phalarine	KNApSAcK: C00026961

MSnスペクトル情報

Level: 2, プリカーサーm/z: 405.22644

Splash: splash10-004i-0090000000-3c5e3121e971491cad65

m/z	Int.	NL	Rel.Int.
229.13	2841	176	1000
201.11	870	204	306
211.12	736	194	259
183.09	559	222	196
247.10	558	158	196
289.11	168	116	59

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.188	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Glyinflanin G
0.063	[Flavanone]-A(3OMe)-B(3OMe)	Flavanone	5,6,7,3',4',5'-Hexamethoxyflavanone
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a1
0.000	[Dihydroflavonol]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Dihydroflavonol	MS II
0.000	[Chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Chalcone	Laxichalcone
0.000	[Flavone]-A(1OH, 2OMe)-B(1OH, 3OMe)	Flavone	Psiadiarabicin
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 2OMe)	Flavone	Gardenin C
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 2OMe)	Flavone	5,4'-Dihydroxy-6,7,8,3',5'-pentamethoxyflavone
0.000	[Flavone]-A(1OH, 3OMe)-B(1OH, 2OMe)	Flavone	Agehoustin F
0.000	[Flavonol]-A(1OH, 3OMe)-B(2OMe)	Flavonol	3,5-Dihydroxy-6,7,8,3',4'-pentamethoxyflavone
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6-Methyl-6-(4-Hydroxy-4-methyl-2-pentenyl)pyrano)))-B(none)	2'-Hydroxychalcone	Boesenbergin A
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6-Methyl-6-(4-Hydroxy-4-methyl-2-pentenyl)pyrano)))-B(none)	2'-Hydroxychalcone	Boesenbergin B
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([@@]-Methylenedioxy))-B(1OH, 3OMe)	2'-Hydroxychalcone	2,2'-Dihydroxy-3,4,5,6'-tetramethoxy-3',4'-methylenedioxychalcone
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	beta-Hydroxy(or Oxodihydro)chalcone	Glyinflanin D
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(4-(p-Hydroxyphenyl)-6-oxodihydropyrano)))-B(none)	Dihydrochalcone	Calomelanol C
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(1OH)	Dihydrochalcone	Calomelanol B
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Hydroxy-3-methyl-1-butenyl))-B(none)	Flavone	Fulvinervin C
0.000	[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavone	Laxifolin
0.000	[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavone	Isolaxifolin
0.000	[Flavonol]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavonol	Sericetin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	Apuleirin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	Murrayanol
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,3'-Dihydroxy-3,6,7,4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(2OH, 1OMe)	Flavonol	Apulein
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	6,5'-Dihydroxy-3,5,7,2',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	6,2'-Dihydroxy-3,5,7,4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	5,5'-Dihidroxy-3,6,7,2',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavonol	Brickellin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OMe)	Flavonol	Distemonatin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OMe)	Flavonol	Conyzatin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(3OMe)	Flavonol	5,8-Dihydroxy-3,7,2',3',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,6,7,8,3'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	5,3'-Dihydroxy-3,6,7,8,4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OMe)	Flavonol	5,7-Dihydroxy-3,6,8,3',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,6,7,8,2'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavonol	5,2'-Dihydroxy-3,6,7,8,4'-pentamethoxyflavone
0.000	[4-substituted Flavan (4-(4-Hydroxystyryl))]-A(2OMe)-B(1OH)	4-substituted Flavan	4'-Hydroxy-4-(4-hydroxystyryl)-5,7-dimethoxyflavan
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Isoflavone	Osajin
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Isoflavone	Chandalone
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Isoflavone	Warangalone
0.000	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Isochandalone
0.000	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavone	Ulexone A
0.000	[Coumestan]-A(1OH, 1Geranyl)-B(1OH)	Coumestan	Puerarol
0.000	[4-phenylcoumarin]-A(1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(5,6-Dimethyl-4-hydroxydihydropyrano)))-B(none)	4-phenylcoumarin	Inophyllolide chromanol
0.000	[4-phenylcoumarin]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(5,6-Dimethyl-4-oxodihydropyrano)))-B(none)	4-phenylcoumarin	5-Hydroxy-10-prenyl-7,8-dihydro-7,8-trans-dimethyl-4-phenyl-2H,6H-benzo[1,2-b:5,4-b']dipyran-2,6-dione
0.000	[4-phenylcoumarin]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Isovaleryl)-B(none)	4-phenylcoumarin	Mammeigin
0.000	[4-phenylcoumarin]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(2-Methylbutyroyl))-B(none)	4-phenylcoumarin	5-Hydroxy-6'',6''-dimethyl-6-(2-methylbutyryl)-4-phenylpyrano[2'',3'':7,8]coumarin

Level: 3, プリカーサーm/z: 229.12561

Splash: splash10-03e9-0890000000-49783f7ed8dcdcf91631

m/z	Int.	NL	Rel.Int.
211.07	2032	18	1000
183.08	1883	46	926
201.10	988	28	486
185.15	390	44	191
143.08	290	86	142
187.08	251	42	123
157.06	129	72	63

Level: 3, プリカーサーm/z: 201.10742

Splash: splash10-00di-0900000000-f09eaeeec9d367003b98

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	共有数
	90.57	443.18313	37.9561	0.20	[M+K]+	(40 names) Kuhistanicaol E; (+)-Kuhistanicaol E; Emblide; (+)-Emblide; Dactylolactone C; (-)-Dactylolactone C; Phellodonic acid; Cortisol 21-acetate; Hydrocortisone acetate; Cortell; 4beta,8alpha-Dihydroxy-6alpha-vanilloy...	ALL 29 KG 2 KN 20 HM 3 LM 4			2
	90.55	422.25358	17.0265	0.94	[M+NH4]+	(40 names) Kuhistanicaol E; (+)-Kuhistanicaol E; Emblide; (+)-Emblide; Dactylolactone C; (-)-Dactylolactone C; Phellodonic acid; Cortisol 21-acetate; Hydrocortisone acetate; Cortell; 4beta,8alpha-Dihydroxy-6alpha-vanilloy...	ALL 29 KG 2 KN 20 HM 3 LM 4			2
10109	90.54	405.22705	0.0000	1.07	[M+H]+	(40 names) Kuhistanicaol E; (+)-Kuhistanicaol E; Emblide; (+)-Emblide; Dactylolactone C; (-)-Dactylolactone C; Phellodonic acid; Cortisol 21-acetate; Hydrocortisone acetate; Cortell; 4beta,8alpha-Dihydroxy-6alpha-vanilloy...	ALL 29 KG 2 KN 20 HM 3 LM 4	MS2 MS3 x 2	0.188	2

m/z	Int.	NL	Rel.Int.
173.03	263	28	1000
159.10	109	42	413
186.10	68	15	258
183.06	46	18	176
145.03	25	56	93
158.39	19	43	70
131.01	15	70	57
157.11	14	44	52

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

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