ピーク情報

シロイヌナズナ　地上部

pos

Peak #8625 MN MID: SE200_S1_M90

m/z: 777.40356, RT: 80.89, 強度: 213793, ログ強度: 1.81, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (8 names) Agaveside B;Alliospiroside D;(23S,24R,25S)-23,24-dihydroxy-spirost-5-en-3beta-yl O-alpha-L-rhamnopyranosyl-(1-2)-beta-D-glucopyranoside;Surculoside B;Turrillianoside;(25R)-spirost-7-ene-3beta,5alpha,6...

DBごとのヒット数: ALL 8 KN 4 HM 2 LM 2

FlavonoidSearch最大スコア MS2: -, MS3: 0.065

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
C39H62O14	754.41396	0.513	Agaveside B	HMDB: HMDB0034211 KNApSAcK: C00054061 LipidMAPS: LMST01080078
C39H62O14	754.41396	0.513	Alliospiroside D	HMDB: HMDB0030915 KNApSAcK: C00054801
C39H62O14	754.41396	0.513	(23S,24R,25S)-23,24-dihydroxy-spirost-5-en-3beta-yl O-alpha-L-rhamnopyranosyl-(1-2)-beta-D-glucopyranoside	LipidMAPS: LMST01080059
C39H62O14	754.41396	0.513	Surculoside B	KNApSAcK: C00046944
C39H62O14	754.41396	0.513	Turrillianoside	KNApSAcK: C00034733
C39H62O14	754.41396	0.513	Pamaqueside	HMDB: HMDB0256102
C39H62O14	754.41396	0.513	(25R)-spirost-7-ene-3beta,5alpha,6beta-triol-3-O-alpha-l-rhamnopyranosyl-(1-2)-beta-d-glucopyranoside	LipidMAPS: LMST01080104
C39H62O14	754.41396	0.513	Schidigerasaponin C2	HMDB: HMDB0036251

MSnスペクトル情報

Level: 2, プリカーサーm/z: 777.40289

Splash: splash10-0uxr-0000950000-fa712ddcbabfc234b37a

m/z	Int.	NL	Rel.Int.
453.29	51714	324	1000
565.38	27694	212	535
454.27	10155	323	196
566.44	8381	211	162
347.31	3206	430	61

Level: 3, プリカーサーm/z: 565.37915

Splash: splash10-001i-0001900000-f700354066d9fe40e5c6

m/z	Int.	NL	Rel.Int.
481.34	6325	84	1000
409.30	1921	156	303
423.38	1496	142	236
482.37	1166	83	184
347.31	1130	218	178
533.57	931	32	147
403.33	881	162	139
313.14	777	252	122
451.30	512	114	80
240.95	435	324	68
439.36	380	126	60
410.32	365	155	57

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 1
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Schaftoside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	Isocorymboside
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Neocorymboside
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Xylopyranosyl-8-C-galactopyranosylapigenin
[Flavone]-A(2OH, 1(C-Galactosyl), 1(C-Xylosyl))-B(1OH)	Flavone	6-C-Galactopyranosyl-8-C-xylopyranosylapigenin
[Flavone]-A(2OH, 1(C-Glu), 1(C-Xylosyl))-B(1OH)	Flavone	Vicenin 3
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Isoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Arabinosyl))-B(1OH)	Flavone	Neoisoschaftoside
[Flavone]-A(2OH, 1(C-Glu), 1(C-Apiofuranosyl))-B(1OH)	Flavone	6-C-beta-D-Glucopyranosyl-8-C-beta-D-apiofuranosylapigenin
[Flavone]-A(2OH, 1(C-Arabinosyl), 1(C-Galactosyl))-B(1OH)	Flavone	Corymboside

Level: 3, プリカーサーm/z: 453.28540

Splash: splash10-0006-0092100000-cc61f906d7a3eea8cc9c

m/z	Int.	NL	Rel.Int.
291.11	1872	162	1000
259.04	1014	194	541
242.91	858	210	458
277.14	635	176	339
303.16	632	150	337
425.21	536	28	286
184.99	371	268	197
235.17	305	218	162
241.11	286	212	153
367.41	286	86	152
202.96	248	250	132
435.28	248	18	132
407.33	187	46	99
292.28	153	161	81
345.34	142	108	76
385.33	133	68	71
423.28	121	30	64
363.03	104	90	55

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.100	[Flavanone]-A(1OH, 1OMe, 2(C-Prenyl))-B(1OH, 1OMe)	Flavanone	Amoradinin
0.057	[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

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

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FlavonoidSearch結果

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