ピーク情報

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Peak #3344 MN MID: SE199_S41_M90

m/z: 787.20882, RT: 43.75, 強度: 119598, ログ強度: 1.49, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 6

DB検索結果: (13 names) Petunoside;Kaempferol 3-(6''-(E)-feruloylglucosyl)-(1->2)-galactoside;5,7-Dihydroxy-3-[[2-O-[6-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propenyl]-beta-D-glucopyranosyl]-beta-D-galactopyranosyl]ox...

DBごとのヒット数: ALL 11 KN 10 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: 1.000

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
C37H38O19	786.20073	1.032	Petunoside	FlavonoidViewer: FL5FAAGL0081 KNApSAcK: C00005882 LipidMAPS: LMPK12111803
C37H38O19	786.20073	1.032	Kaempferol 3-(6''-(E)-feruloylglucosyl)-(1->2)-galactoside	FlavonoidViewer: FL5FAAGS0117 KNApSAcK: C00013784 LipidMAPS: LMPK12111952
C37H38O19	786.20073	1.032	Isoorientin 4'-O-glucoside 2''-O-(E)-ferulate	FlavonoidViewer: FL3FACDS0018 KNApSAcK: C00006331 LipidMAPS: LMPK12110626
C37H38O19	786.20073	1.032	Cyanidin 3-(6''-ferulylglucoside)-5-glucoside	FlavonoidViewer: [1]FL7AACGL0052 HMDB: [1]HMDB0037987 KNApSAcK: [1]C00006823 LipidMAPS: [1]LMPK12010161
C37H38O19	786.20073	1.032	Peonidin 3-[6-(3-glucosylcaffeyl)glucoside]	FlavonoidViewer: [1]FL7AADGL0015 KNApSAcK: [1]C00006863 LipidMAPS: [1]LMPK12010246
C37H38O19	786.20073	1.032	Petunidin 3-(6''-p-coumarylglucoside)-5-glucoside	FlavonoidViewer: [1]FL7AAHGL0013 HMDB: [1]HMDB0038100 KNApSAcK: [1]C00006898 LipidMAPS: [1]LMPK12010360
C37H38O19	786.20073	1.032	Isorhamnetin 3-O-beta-(6''-O-E-p-coumaroylglucoside)-7-O-beta-glucoside	FlavonoidViewer: FL5FADGL0040 KNApSAcK: C00011130 LipidMAPS: LMPK12110594
C37H38O19	786.20073	1.032	Isoorientin 7-O-(6'''-O-(E)-feruloyl)glucoside	FlavonoidViewer: FL3FACDS0026 KNApSAcK: C00014097 LipidMAPS: LMPK12110634
C37H38O19	786.20073	1.032	Isoorientin 2''-[feruloyl-(->6)-glucoside]	HMDB: HMDB0032911
C37H38O19	786.20073	1.032	Kaempferol 3-(2''-(E)-feruloylgalactosyl-(1->4)-glucoside)	FlavonoidViewer: FL5FAAGS0114 HMDB: HMDB0301960 KNApSAcK: C00013781 LipidMAPS: LMPK12111949
C37H38O19	786.20073	1.032	Ozturkoside B	KNApSAcK: C00035719

MSnスペクトル情報

Level: 2, プリカーサーm/z: 787.20819

Splash: splash10-03dj-0005902000-9c0840c312de825890c8

m/z	Int.	NL	Rel.Int.
463.15	38627	324	1000
445.19	19774	342	511
343.13	15870	444	410
625.15	13239	162	342
367.19	10823	420	280
313.21	8960	474	231
397.14	8760	390	226
449.16	6315	338	163
409.25	6312	378	163
427.16	6194	360	160
769.19	5556	18	143
607.19	4315	180	111
431.23	3272	356	84
353.17	2838	434	73
329.20	2710	458	70
299.18	2485	488	64
667.14	2138	120	55
391.19	1962	396	50

Level: 3, プリカーサーm/z: 463.19305

Splash: splash10-0002-0004900000-6eba76bf485685fa5d02

m/z	Int.	NL	Rel.Int.
445.20	10541	18	1000
397.23	3266	66	309
343.18	1842	120	174
367.20	1612	96	152
427.19	1599	36	151
409.28	932	54	88

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	Isoscoparin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	6-C-beta-D-Glucopyranosyldiosmetin
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Swertiajaponin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	Scoparin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	8-C-beta-D-Glucopyranosyldiosmetin
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Parkinsonin A
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Isoswertiajaponin
1.000	[Flavonol]-A(1OH, 1OMe, 1(C-Glu))-B(1OH)	Flavonol	Keyakinin
1.000	[Isoflavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Isoflavone	Dalpanitin
0.000	[Flavone]-A(4OMe)-B(4OMe)	Flavone	Agehoustin A
0.000	[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone]-A(2OH, 3(C-Prenyl))-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone	Helilupolone
0.000	[Flavonol]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(2OH)	Flavonol	6-C-Rhamnopyranosylrhamnetin
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(3OMe)	Flavonol	Exoticin
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(3OMe)	Flavonol	Purpurascenin
0.000	[Flavan]-A(1OH, 1(1,1-Dimethylallyl))-B(2OH, 2(C-Prenyl))	Flavan	Kazinol E
0.000	[Flavan]-A(1OH, 1(1,1-Dimethylallyl))-B(2OH, 2(C-Prenyl))	Flavan	Kazinol Q
0.000	[CCS-type derivative / [2,3,4:5,4a,4]-(6-Phenylpyrano)anthocyanidin (3',4'-Dihydroxy)]-A(1OH)-B(1OH, 2OMe)	CCS-type derivative / [2,3,4:5,4a,4]-(6-Phenylpyrano)anthocyanidin	Malvidin 4-vinylcatechol
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Euchrenone b3

Level: 3, プリカーサーm/z: 445.10004

Splash: splash10-016s-0009500000-e31ba0c5508acb2e8ca6

m/z	Int.	NL	Rel.Int.
367.20	2972	78	1000
427.12	2469	18	830
397.11	2328	48	783
409.16	1251	36	421
325.15	392	120	131
313.22	364	132	122

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

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Flavone	7-Hydroxy-5,4'-dimethoxyflavone 8-C-rhamnoside
[Flavone]-A(2OH, 1(3,4-Dihydroxy-6-methyl-5-oxotetrahydro-2-pyranyl))-B(1OH, 1OMe)	Flavone	3'-O-Methylderhamnosylmaysin
[Flavone]-A(2OH, 1(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl))-B(1OH, 1OMe)	Flavone	6-C-(6-Deoxy-ribo-hexos-3-ulosyl)diosmetin
[UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethenoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethenoflavone	Artomunoxanthentrione
[Isoflavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Isoflavone	Isovolubilin
[Isoflavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Isoflavone	Volubilin