ピーク情報

細ネギ（若香）地下部

pos

Peak #10133 MN MID: SE201_S21_M90

m/z: 489.35757, RT: 98.11, 強度: 9668, ログ強度: 0.40, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (16 names) Sublateriol C;(+)-Sublateriol C;Sublateriol B;(+)-Sublateriol B;Lycernuic acid D;Quadrangularic acid L;(+)-Quadrangularic acid L;R1-Barrigenol;16beta-acetoxy-ergosta-22E-en-3beta,,5alpha,6beta,7beta,t...

DBごとのヒット数: ALL 11 KN 9 LM 2

FlavonoidSearch最大スコア MS2: -, MS3: 0.050

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
C30H50O6	506.36074	0.230	Sublateriol B	KNApSAcK: C00033391
C30H50O6	506.36074	0.230		LipidMAPS: LMPK09000039
C30H50O6	506.36074	0.230	16beta-acetoxy-ergosta-22E-en-3beta,,5alpha,6beta,7beta,tetraol	LipidMAPS: LMST01031168
C30H50O6	506.36074	0.230	Gymnemagenin	HMDB: HMDB0034519 KNApSAcK: C00037231
C30H50O6	506.36074	0.230	13beta,17beta-Epoxyalisol A	KNApSAcK: C00033525
C30H50O6	506.36074	0.230	7beta,23,24,25,28-pentahydroxy-9beta,19-cyclolanostan-3-one	LipidMAPS: LMST01100058
C30H50O6	506.36074	0.230		LipidMAPS: LMPK09000041
C30H50O6	506.36074	0.230	Lycernuic acid D	KNApSAcK: C00051357
C30H50O6	506.36074	0.230	Sublateriol C	KNApSAcK: C00033392
C30H50O6	506.36074	0.230	Quadrangularic acid L	KNApSAcK: C00046873
C30H50O6	506.36074	0.230	R1-Barrigenol	HMDB: HMDB0302409 KNApSAcK: C00034652
C30H50O6	506.36074	0.230	16beta-acetoxy-5alpha-ergosta-22E-en-3beta,,6beta,7beta,11beta,tetraol	LipidMAPS: LMST01031170
C30H50O6	506.36074	0.230	Cordianol A	KNApSAcK: C00044649
C30H50O6	506.36074	0.230	Sodwanone L	KNApSAcK: C00050308

MSnスペクトル情報

Level: 2, プリカーサーm/z: 489.35736

Splash: splash10-00di-0000900000-0aedfd28039030f11938

m/z	Int.	NL	Rel.Int.
471.40	8025	18	1000
453.46	2529	36	315
435.44	2352	54	293
417.36	752	72	93
355.42	428	134	53

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(1OH, 1Methyl, 1([2,3:@@]-(4-Isopropyl-6,6,8,8-tetramethyl-5,7-dioxy-4,8-dihydrochromeno)))-B(none)	Flavanone	Lumaflavanone A
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Amorin
[Flavanone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Flemichin A
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a11
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a12
[Flavone]-A(1OH, 1OMe, 1(1(O-Acetyl)-C-Glu))-B(1OH)	Flavone	Isoswertisin 2''-O-acetate
[3-substituted Flavone (3-Geranyl)]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	3-substituted Flavone	Rubraflavone D
[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))	3-substituted Flavone	Sanggenone K
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 2(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Artelastin
[Flavonol]-A(2OH, 2(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavonol	Dorsilurin C

Level: 3, プリカーサーm/z: 471.40683

Splash: splash10-0udi-0000900000-90214bc998ca04dfb2cb

m/z	Int.	NL	Rel.Int.
453.42	1637	18	1000
435.48	654	36	399
417.51	218	54	133
425.50	119	46	72
407.50	93	64	56

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[2'-Hydroxychalcone]-A(1OH, 2OMe, 1([2,3:@@]-(5-Oxo-4-(1-Hydroxy-3-phenylallylidene)-4,5-dihydrofurano)))-B(none)	2'-Hydroxychalcone	Didymocalyxin B

Level: 3, プリカーサーm/z: 453.49075

Splash: splash10-000i-0000900000-787786429d182ea0c672

m/z	Int.	NL	Rel.Int.
435.42	555	18	1000
417.47	81	36	145
425.63	50	28	90
407.38	49	46	88
297.25	30	156	53
309.34	28	144	50

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.050	[Flavanone]-A(1OH, 1OMe, 2(C-Prenyl))-B(1OH, 1OMe)	Flavanone	Amoradinin
0.042	[Flavonol]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe)	Flavonol	Dorsmanin D
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydro-4-hydroxy-5-methoxypyrano)))-B(1OH)	2'-Hydroxychalcone	Derrichalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1Lavandulyl)-B(1OH, 1OMe)	2'-Hydroxychalcone	Kushenol D
0.000	[Dihydrochalcone]-A(2OH, 1(2-Hydroxybenzyl), 1([2,3:@@]-(4-hydrochromeno)))-B(none)	Dihydrochalcone	Chamuvaritin
0.000	[Dihydrochalcone]-A(3OH, 1(C-Glu))-B(2OH)	Dihydrochalcone	Aspalathin
0.000	[Dihydrochalcone alpha-ol]-A(2OH, 1(C-Glu))-B(2OH)	Dihydrochalcone alpha-ol	Coatline B
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Methoxy-4,4-dimethyl-2-oxetanylmethyl))-B(1OH)	Flavanone	Derriflavanone
0.000	[Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(1OH, 1OMe)	Flavanone	2'-Methoxykurarinone
0.000	[Flavanone]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(5-(Hydroxyisopropanyl)furano)))-B(2OH)	Flavanone	3',4'-Dihydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2'''-(1-hydroxy-1-methylethyl)-furano-(4'',5'':6,5)favanone
0.000	[Flavone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydro-4,5-diacetoxypyrano)))-B(none)	Flavone	9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydroxydihydropyrano)))	Flavone	Epimedokoreanin A
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(2OH, 1OMe, 1(C-Prenyl))	3-substituted Flavone	Heteroartonin A
0.000	[CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone	Artonin S
0.000	[Flavonol (3-OMe)]-A(2OH, 2(C-Prenyl))-B(2OH)	Flavonol	Broussoflavonol B
0.000	[Flavan 3-ol]-A(2OH, 1(C-Glu))-B(2OH)	Flavan 3-ol	6-C-Glucopyranosylcatechin
0.000	[Flavan 3-ol]-A(2OH, 1(C-Glu))-B(2OH)	Flavan 3-ol	8-C-Glucopyranosylcatechin
0.000	[Flavan 3-ol]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavan 3-ol	Catechin 8-C-beta-D-galactoside
0.000	[Flavan 3-ol]-A(1OH, 1([2,3:@@]-(4-(3,4-Dihydroxyphenyl)-6-oxodihydropyrano)))-B(2OH)	Flavan 3-ol	Cinchonain Ib
0.000	[Flavan 3-ol]-A(1OH, 1([2,3:@@]-(4-(3,4-Dihydroxyphenyl)-6-oxodihydropyrano)))-B(2OH)	Flavan 3-ol	Cinchonain Ic
0.000	[Flavan 3-ol]-A(2OH)-B(3OH)-C(1(O-p-Coumaroyl))	Flavan 3-ol	Gallocatechin 3-O-p-coumarate