ピーク情報

こむぎ［パン類］食パン

pos

Peak #1368 MN MID: SE112_S010261_M90

m/z: 569.16825, RT: 13.30, 強度: 37337, ログ強度: 1.18, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 7

DB検索結果: alpha-1,5-L-Arabinotetraose

DBごとのヒット数: ALL 1 KG 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.048

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
C20H34O17	546.17960	-1.038	alpha-1,5-L-Arabinotetraose	KEGG: C20572

MSnスペクトル情報

Level: 2, プリカーサーm/z: 569.16803

Splash: splash10-0a4r-0007930000-1252c1af48e2349a9ae2

m/z	Int.	NL	Rel.Int.
407.18	23418	162	1000
389.18	16711	180	713
509.22	5448	60	232
551.35	3109	18	132
365.17	1604	204	68

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(2OH, 1(1(O-p-Hydroxybenzoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-p-hydroxybenzoate
[Flavone]-A(2OH, 1(1(O-p-Hydroxybenzoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-p-hydroxybenzoate
[Flavone]-A(2OH, 1(1(O-p-Hydroxybenzoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-p-hydroxybenzoate
[Flavone]-A(2OH, 1(1(O-p-Hydroxybenzoyl)-C-Glu))-B(2OH)	Flavone	2''-O-p-Hydroxybenzoylorientin
[Flavonol (3-OMe)]-A(1OMe, 1([2,3:@@]-(5-Hydroxymethyl-6-(4-hydroxy-2,3-dimethoxyphenyl)-dihydro[1,4]dioxinyl)))-B(1OH, 1OMe)	Flavonol	6,8-Dimethoxy-2,3-trans-2-(4-hydroxy-2,3-dimethoxyphenyl)-9-(5-hydroxy-2-methoxyphenyl)-3-hydroxymethyl-2,3-dihydro-7H-1,4-dioxono[2,3-h]chromene-7-one

Level: 3, プリカーサーm/z: 407.17706

Splash: splash10-0002-0029000000-d25a24f4586fb19f1b7a

m/z	Int.	NL	Rel.Int.
347.24	2587	60	1000
389.18	923	18	356
203.03	300	204	116
227.11	286	180	110
245.14	246	162	95
287.34	240	120	92

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.048	[Flavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Flavone	Gancaonin Q
0.048	[Flavone]-A(2OH)-B(1OH, 2(C-Prenyl))	Flavone	Honyucitrin
0.045	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Isoflavone	Lupalbigenin
0.045	[Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	Isoflavone	Isolupalbigenin
0.045	[Isoflavone]-A(2OH)-B(1OH, 2(C-Prenyl))	Isoflavone	3',5'-Diprenylgenistein
0.045	[Isoflavone]-A(2OH, 2(C-Prenyl))-B(1OH)	Isoflavone	6,8-Diprenylgenistein
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OMe, 1(C-Prenyl))	Pterocarpan	Erycristin
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(2OH)	2'-Hydroxychalcone	Flemiwallichin D
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1Geranyl)-B(1OH)	2'-Hydroxychalcone	Xanthoangelol F
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Paratocarpin F
0.000	[2'-Hydroxychalcone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Angusticornin A
0.000	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	3,2',4'-Trihydroxy-6'',6''-dimethyl-3'-prenylpyrano[2'',3'':4,5]chalcone
0.000	[2'-Hydroxychalcone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	2'-Hydroxychalcone	2,4,2'-Trihydroxy-6'',6''-dimethyl-3'-prenylpyrano[2'',3'':4',5']chalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	2'-Hydroxychalcone	Flemingin A
0.000	[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-6-(4-Hydroxy-4-methyl-2-pentenyl)pyrano)))-B(none)	2'-Hydroxychalcone	Flemiwallichin F
0.000	[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	2'-Hydroxychalcone	Flemingin D
0.000	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(6-Isopropyl-3-methyl-2-cyclohexenyl))-B(none)	2'-Hydroxychalcone	2',6'-Dihydroxy-3'-(1-p-menthen-3-yl)-4'-methoxychalcone
0.000	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	2'-Hydroxychalcone	Sericone
0.000	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	2'-Hydroxychalcone	Xanthohumol E
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	beta-Hydroxy(or Oxodihydro)chalcone	Glyinflanin C
0.000	[beta-Hydroxy(or Oxodihydro)chalcone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	beta-Hydroxy(or Oxodihydro)chalcone	Glycyrdione B
0.000	[UBR-type derivative / 2',4'-Dioxo-5'-enyl-0-hydroxy-type Chalcone]-A(1OMe, 2(C-Prenyl))-B(none)	UBR-type derivative / 2',4'-Dioxo-5'-enyl-0-hydroxy-type Chalcone	Tunicatachalcone
0.000	[Dihydrochalcone]-A(1OH, 1OMe, 1([2,3:@@]-(5-Isopropyl-7a-methyl-3a,4,5,7a-tetrahydrobenzofurano)))-B(none)	Dihydrochalcone	Adunctin B
0.000	[Dihydrochalcone]-A(1OH, 1OMe, 1([2,3:@@]-(8-Isopropyl-1-oxaspiro[4.5]-2,6-decadieno)))-B(none)	Dihydrochalcone	Adunctin C
0.000	[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Methyl)-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone	Grenoblone
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavanone	Minimiflorin
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavanone	Cajaflavanone
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavanone	Lupinifolin
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Flavanone	Euchrenone a2
0.000	[Flavanone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Paratocarpin H
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Flavanone	Paratocarpin I
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH)	Flavanone	Cycloaltilisin 7
0.000	[3-substituted Flavone (3-Geranyl)]-A(1OH)-B(2OH)	3-substituted Flavone	Rubraflavone A
0.000	[Flavone]-A(1OH, 1OMe, 1(5-Methoxy-6-methyl-4-oxo-4H-pyran-3-yl))-B(none)	Flavone	Hoslundin
0.000	[Flavone]-A(2OH)-B(1OH, 1Geranyl)	Flavone	Kuwanone S
0.000	[Dihydroflavonol]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1(C-Prenyl))	Dihydroflavonol	Kanzonol Z
0.000	[Dihydroflavonol]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Dihydroflavonol	Mundulinol
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,7,3',5'-Tetrahydroxy-3,6,8,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,7,3',4'-Tetrahydroxy-3,6,8,5'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,6,3',5'-Tetrahydroxy-3,7,8,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,7,4',5'-Tetrahydroxy-3,6,8,2'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,7,2',5'-Tetrahydroxy-3,6,8,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH, 1OMe)	Flavonol	5,7,2',4'-Tetrahydroxy-3,6,8,5'-tetramethoxyflavone
0.000	[Isoflavan]-A(1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(1OH, 1OMe)	Isoflavan	Heminitidulan
0.000	[6-Oxodehydrorotenone]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe)	6-Oxodehydrorotenone	Rotenonone
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1Isovaleryl)-B(none)	4-phenylcoumarin	Mammeisin
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1(2-Methylbutyroyl))-B(none)	4-phenylcoumarin	5,7-Dihydroxy-8-(3-methylbut-2-enyl)-6-(2-methylbutyryl)-4-phenylcoumarin
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1Isovaleryl)-B(none)	4-phenylcoumarin	Mammea A/BA
0.000	[4-phenylcoumarin]-A(2OH, 1(C-Prenyl), 1(2-Methylbutyroyl))-B(none)	4-phenylcoumarin	Mammea A/BB

Level: 3, プリカーサーm/z: 389.24060

Splash: splash10-004i-0190000000-e2132946a6a79b60bbbb

m/z	Int.	NL	Rel.Int.
227.12	1458	162	1000
203.07	369	186	253
287.14	296	102	203
185.02	260	204	178
329.33	126	60	86
259.09	86	130	59

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.188	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	2'-Hydroxychalcone	Paratocarpin A
0.188	[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Xambioona
0.063	[Chalcone]-A(3OMe)-B(3OMe)	Chalcone	2,3,4,2',4',6'-Hexamethoxychalcone
0.048	[Flavonol]-A(3OMe)-B(2OMe)	Flavonol	Quercetagetin 5,6,7,3',4'-pentamethyl ether
0.048	[Flavonol]-A(2OMe)-B(3OMe)	Flavonol	3-Hydroxy-5,7,3',4',5'-pentamethoxyflavone
0.000	[Chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Chalcone	Flemiculosin
0.000	[Flavone]-A(1OMe, 2(C-Prenyl))-B(none)	Flavone	5-Methoxy-7,8-diprenylflavone
0.000	[Flavone]-A(1OH, 1OMe)-B(4OMe)	Flavone	5-Hydroxy-7,2',3',4',5'-pentamethoxyflavone
0.000	[Flavone]-A(3OMe)-B(1OH, 2OMe)	Flavone	Ageconyflavone C
0.000	[Flavone]-A(1OH, 2OMe)-B(3OMe)	Flavone	Umuhengerin
0.000	[Flavone]-A(1OH, 2OMe)-B(3OMe)	Flavone	Agehoustin G
0.000	[Flavone]-A(1OH, 2OMe)-B(3OMe)	Flavone	Serpyllin
0.000	[Flavone]-A(4OMe)-B(1OH, 1OMe)	Flavone	3'-Hydroxy-5,6,7,8,4'-pentamethoxyflavone
0.000	[Flavone]-A(1OH, 3OMe)-B(2OMe)	Flavone	Demethylnobiletin
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(none)	Dihydrochalcone	Calomelanol D-1
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Methylbutadienyl))-B(none)	Flavanone	Spinoflavanone A
0.000	[Flavanone]-A(2OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydroxydihydropyrano)))	Flavanone	Sigmoidin G
0.000	[Flavanone]-A(3OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavanone	Agecorynin A
0.000	[Flavone]-A(1OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavone	Kanzonol E
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1OH, 2OMe)	Flavonol	2'-Hydroxy-3,7,8,4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(3OMe)	Flavonol	Combretol
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1OH, 2OMe)	Flavonol	5'-hydroxy-3,5,7,2',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1OH, 2OMe)	Flavonol	2'-Hydroxy-3,5,7,4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(3OMe)	Flavonol	5-Hydroxy-3,7,2',4',5'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Grantiodin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Quercetagetin 3,5,6,3',4'-pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,6,7,3'-pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Artemetin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(1OH, 1OMe)	Flavonol	8-C-Methylquercetagetin 3,6,7,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(1OH, 1OMe)	Flavonol	8-C-Methylquercetagetin 3,6,7,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(1OH, 1OMe)	Flavonol	Gossypetin 3,5,7,8,3'-pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Gossypetin 3,5,8,3',4'-pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Gossypetin 3,7,8,3',4'-pentamethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OMe)	Flavonol	5-Hydroxy-3,7,8,2',4'-pentamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OMe)	Flavonol	Emmaosunin
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OMe)	Flavonol	5-Hydroxyauranetin
0.000	[Flavonol]-A(1OH, 3OMe)-B(1([@@]-Methylenedioxy))	Flavonol	3,5-Dihydroxy-6,7,8-trimethoxy-3',4'-methylenedioxyflavone
0.000	[Pterocarpan-6a-ol]-A(1OH)-B(1OH, 1OMe, 1(3-hydroxy-3-methylbutyl))	Pterocarpan-6a-ol	Sphenostylin C