ピーク情報

ポプラ, 幼植物, 地上部

pos

Peak #2532 MN MID: SE205_S08_M90

m/z: 713.15655, RT: 36.52, 強度: 16011, ログ強度: 0.61, アダクト: [2M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (5 names) Caffeic acid 4-O-glucuronide;3,5-Dihydroxycinnamic acid glucuronide;Caffeoyl C1-glucuronide;Caffeic acid 3-O-glucuronide;5-Amino-6-(5'-phosphoribitylamino)uracil

DBごとのヒット数: ALL 5 KG 1 HM 4

FlavonoidSearch最大スコア MS2: -, MS3: 0.667

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
C15H16O10	356.07435	0.811	Caffeic acid 4-O-glucuronide	HMDB: HMDB0041707
C15H16O10	356.07435	0.811	3,5-Dihydroxycinnamic acid glucuronide	HMDB: HMDB0240448
C15H16O10	356.07435	0.811	Caffeoyl C1-glucuronide	HMDB: HMDB0041709
C15H16O10	356.07435	0.811	Caffeic acid 3-O-glucuronide	HMDB: HMDB0041705
C9H17O9N4P	356.07332	3.705	5-Amino-6-(5'-phospho-D-ribitylamino)uracil	HMDB: HMDB0003841 KEGG: C04454

MSnスペクトル情報

Level: 2, プリカーサーm/z: 713.15515

Splash: splash10-0gb9-0006900000-046b363ef4a7a93fc12c

m/z	Int.	NL	Rel.Int.
465.02	16305	248	1000
303.06	11664	410	715
551.10	1004	162	61

Level: 3, プリカーサーm/z: 465.01819

Splash: splash10-0udi-0009000000-4094f19fe450dcdc2154

m/z	Int.	NL	Rel.Int.
303.05	22504	162	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(C-Glu))-B(3OH)	Flavone	Isoaffinetin
[Flavone]-A(2OH, 1(C-Glu))-B(3OH)	Flavone	Tricetin 8-C-glucopyranoside
[Flavone]-A(2OH, 1(C-Glu))-B(3OH)	Flavone	6-C-beta-D-Glucopyranosylisoetin
[Flavonol]-A(2OH, 1(C-Glu))-B(2OH)	Flavonol	6-C-Glucosylquercetin
[Flavanone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavanone	Dihydroscoparin
[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Glu))-B(1OH)	Dihydroflavonol	Keyakinol
[Flavonol]-A(2OH, 1(C-Glu))-B(2OH)	Flavonol	8-C-Glucosylquercetin
[Isoflavone]-A(2OH, 2(C-Prenyl))-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Euchrenone b4

Level: 3, プリカーサーm/z: 303.06332

Splash: splash10-0a6r-0391000000-935f857ade065f366d84

m/z	Int.	NL	Rel.Int.
256.94	1131	46	1000
229.09	647	74	572
164.91	415	138	366
303.11	365	-0	322
285.07	326	18	287
247.03	276	56	244
136.96	238	166	210
274.08	200	29	176
149.00	122	154	108
274.94	84	28	73
194.96	81	108	72
219.15	78	84	69
152.91	67	150	59

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.667	[Flavonol]-A(2OH)-B(2OH)	Flavonol	Rhynchosin
0.667	[Flavonol]-A(2OH)-B(2OH)	Flavonol	Melanoxetin
0.667	[Flavonol]-A(2OH)-B(2OH)	Flavonol	Quercetin
0.667	[Flavonol]-A(2OH)-B(2OH)	Flavonol	Morin
0.611	[Flavonol]-A(2OH)-B(2OH)	Flavonol	3,5,7,2',5'-Pentahydroxyflavone
0.611	[Flavonol]-A(2OH)-B(2OH)	Flavonol	Viscidulin I
0.579	[Flavonol]-A(1OH)-B(3OH)	Flavonol	Robinetin
0.579	[Flavonol]-A(1OH)-B(3OH)	Flavonol	3,7,2',3',4'-Pentahydroxyflavone
0.533	[Flavone]-A(2OH)-B(3OH)	Flavone	Tricetin
0.533	[Flavone]-A(2OH)-B(3OH)	Flavone	Isoetin
0.438	[Flavone]-A(3OH)-B(2OH)	Flavone	6-Hydroxyluteolin
0.438	[Flavone]-A(3OH)-B(2OH)	Flavone	Hypolaetin
0.364	[Flavonol]-A(3OH)-B(1OH)	Flavonol	6-Hydroxykaempferol
0.364	[Flavonol]-A(3OH)-B(1OH)	Flavonol	Herbacetin
0.353	[Anthocyanidin]-A(2OH)-B(3OH)	Anthocyanidin	Delphinidin
0.353	[Anthocyanidin]-A(3OH)-B(2OH)	Anthocyanidin	6-Hydroxycyanidin
0.333	[Isoflavone]-A(3OH)-B(2OH)	Isoflavone	5,7,8,2',4'-Pentahydroxyisoflavone
0.235	[Isoflavanone]-A(2OH)-B(1OH, 1OMe)	Isoflavanone	Ferreirin
0.235	[Isoflavanone]-A(2OH)-B(1OH, 1OMe)	Isoflavanone	Isoferreirin
0.235	[Isoflavanone]-A(1OH)-B(2OH, 1OMe)	Isoflavanone	7,2',3'-Trihydroxy-4'-methoxyisoflavanone
0.211	[Chalcone]-A(2OH)-B(2OH, 1OMe)	Chalcone	3,4,3',4'-Tetrahydroxy-2-methoxychalcone
0.211	[Flavanone]-A(2OH)-B(1OH, 1OMe)	Flavanone	Alysifolinone
0.211	[Flavanone]-A(2OH)-B(1OH, 1OMe)	Flavanone	Homoeriodictyol
0.211	[Flavanone]-A(2OH)-B(1OH, 1OMe)	Flavanone	Hesperetin
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	8-Methoxybutin
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	7,2',6'-Trihydroxy-5-methoxyflavanone
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	Scutamoenin
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	5,2',3'-Trihydroxy-7-methoxyflavanone
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	Eriodictyol 5-methyl ether
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	Sternbin
0.150	[Flavanone]-A(1OH, 1OMe)-B(2OH)	Flavanone	Artocarpanone
0.150	[Flavanone]-A(3OH)-B(1OMe)	Flavanone	4'-O-Methylcarthamidin
0.150	[Flavanone]-A(3OH)-B(1OMe)	Flavanone	5,7,8-Trihydroxy-4'-methoxyflavanone
0.143	[Dihydroflavonol]-A(2OH, 1OMe)-B(none)	Dihydroflavonol	3,5,8-Trihydroxy-7-methoxyflavanone
0.143	[Dihydroflavonol]-A(1OH, 1OMe)-B(1OH)	Dihydroflavonol	Aromadendrin 5-methyl ether
0.143	[Dihydroflavonol]-A(1OH, 1OMe)-B(1OH)	Dihydroflavonol	Aromadendrin 7-methyl ether
0.133	[Flavan 3-ol]-A(1OH, 1OMe)-B(1OMe)	Flavan 3-ol	Afzelechin 5,4'-dimethyl ether
0.118	[Dihydroflavonol]-A(2OH, 1OMe)-B(none)	Dihydroflavonol	Alnustinol
0.118	[Dihydroflavonol]-A(2OH)-B(1OMe)	Dihydroflavonol	Aromadendrin 4'-methyl ether
0.095	[Flavanone]-A(3OH, 1OMe)-B(none)	Flavanone	Oresbiusin
0.095	[Flavanone]-A(2OH, 1OMe)-B(1OH)	Flavanone	5,7,4'-Trihydroxy-6-methoxyflavanone
0.095	[Flavanone]-A(2OH, 1OMe)-B(1OH)	Flavanone	5,8,2'-Trihydroxy-7-methoxyflavanone
0.095	[Flavanone]-A(2OH, 1OMe)-B(1OH)	Flavanone	5,7,4'-Trihydroxy-8-methoxyflavanone
0.071	[Dihydroflavonol (3-OMe)]-A(1OH)-B(2OH)	Dihydroflavonol	3-O-Methyl-2,3-trans-fustin
0.063	[Isoflavan]-A(1OH, 1OMe)-B(1OH, 1OMe)	Isoflavan	5-Methoxyvestitol
0.063	[Isoflavan]-A(2OMe)-B(2OH)	Isoflavan	Lotisoflavan
0.063	[Isoflavan]-A(1OH)-B(1OH, 2OMe)	Isoflavan	Sphaerosin
0.063	[Isoflavan]-A(1OH)-B(1OH, 2OMe)	Isoflavan	4',7-Dihydroxy-2',3'-dimethoxyisoflavan (+-)
0.063	[Isoflavan]-A(1OH)-B(1OH, 2OMe)	Isoflavan	Mucronulatol
0.063	[Isoflavan]-A(1OH)-B(1OH, 2OMe)	Isoflavan	Isomucronulatol
0.063	[Isoflavan]-A(1OH)-B(1OH, 2OMe)	Isoflavan	Methoxyvestitol
0.059	[Dihydroflavonol (3-OMe)]-A(2OH)-B(1OH)	Dihydroflavonol	Aromadendrin 3-methyl ether
0.050	[2'-Hydroxychalcone]-A(2OH, 1OMe)-B(2OH)	2'-Hydroxychalcone	Lanceoletin
0.050	[2'-Hydroxychalcone]-A(3OH)-B(1OH, 1OMe)	2'-Hydroxychalcone	Okanin 4-methyl ether
0.050	[2'-Hydroxychalcone]-A(3OH)-B(1OH, 1OMe)	2'-Hydroxychalcone	4,2',4',6'-Tetrahydroxy-3-methoxychalcone
0.000	[Dihydrochalcone]-A(1OH, 2OMe)-B(1OH)	Dihydrochalcone	Dihydroflavokawain C
0.000	[Dihydrochalcone]-A(1OH)-B(1OH, 2OMe)	Dihydrochalcone	2,4'-Dihydroxy-4,6-dimethoxydihydrochalcone
0.000	[Dihydrochalcone]-A(1OH)-B(1OH, 2OMe)	Dihydrochalcone	4,4'-Dihydroxy-2,6-dimethoxydihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 1OMe)-B(1OMe)	Dihydrochalcone	Lusianin
0.000	[Dihydrochalcone]-A(2OH, 1OMe)-B(1OMe)	Dihydrochalcone	Calomelanone
0.000	[Dihydrochalcone]-A(2OH, 1OMe)-B(1OMe)	Dihydrochalcone	2',4'-Dihydroxy-4,6'-dimethoxydihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 2OMe)-B(none)	Dihydrochalcone	Dihydropashanone
0.000	[Dihydrochalcone]-A(2OH, 2OMe)-B(none)	Dihydrochalcone	2',4'-Dihydroxy-3',6'-dimethoxydihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 2OMe)-B(none)	Dihydrochalcone	2',3'-Dihydroxy-4',6'-dimethoxydihydrochalcone
0.000	[Aurone]-A(2OH)-B(3OH)	Aurone	Bracteatin
0.000	[Auronol]-A(1OH)-B(1OH, 1OMe)	Auronol	2,6,3'-Trihydroxy-4'-methoxy-2-benzylcoumaranone
0.000	[Auronol]-A(1OH, 1OMe)-B(1OH)	Auronol	Carpusin
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1Methyl)-B(1OH)	Dihydrochalcone	4,2',6'-Trihydroxy-4'-methoxy-3'-methyldihydrochalcone
0.000	[Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(1OMe)	Dihydrochalcone alpha-ol	Odoratol
0.000	[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone]-A(3OH, 2Methyl)-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone	Ceratiolin
0.000	[Flavanone]-A(2OH, 1Methyl)-B(2OH)	Flavanone	5,7,3',5'-Tetrahydroxy-6-methylflavanone
0.000	[Flavanone]-A(2OH, 1Methyl)-B(2OH)	Flavanone	6-C-Methyleriodictylol
0.000	[Flavanone]-A(2OH)-B(2OH, 1Methyl)	Flavanone	5'-C-Methyleriodictylol
0.000	[Dihydroflavonol]-A(2OH, 1Methyl)-B(1OH)	Dihydroflavonol	6-Methylaromadendrin
0.000	[Flavan 4-ol]-A(2OH, 1Hydroxymethyl, 1Methyl)-B(none)	Flavan 4-ol	4,5,7-Trihydroxy-6-hydroxymethyl-8-methylflavan
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol	Peltogynan-4-alpha-ol
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol	Mopanan-4-alpha-ol
0.000	[Flavan]-A(2OH)-B(2OMe)	Flavan	Diffutidin
0.000	[Flavan]-A(2OMe)-B(2OH)	Flavan	3',4'-Dihydroxy-5,7-dimethoxyflavan
0.000	[Pterocarpan-6a-ol]-A(1OH)-B(1OH, 1OMe)	Pterocarpan-6a-ol	6a,7-Dihydroxymedicarpin
0.000	[[3,2']-Methano-4-phenylchroman (3-OH)]-A(2OH)-B(2OH)	[3,2']-Methano-4-phenylchroman	Haematoxylin