ピーク情報

トマト Micro-Tom 成熟果実の果肉

pos

Peak #2568 MN MID: SE203_S21_M90

m/z: 401.04790, RT: 32.38, 強度: 13711, ログ強度: 0.66, アダクト: [M+K]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: 7-O-Galloyl-sedoheptulose

DBごとのヒット数: ALL 1 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.286

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
C14H18O11	362.08491	-0.469	7-O-Galloyl-sedoheptulose	HMDB: HMDB0247276

MSnスペクトル情報

Level: 2, プリカーサーm/z: 401.04782

Splash: splash10-0a4i-0019000000-4afbbe3c69d47d00e3d1

m/z	Int.	NL	Rel.Int.
357.10	1702	44	1000
238.08	251	163	147
176.97	85	224	50

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe)	Dihydroflavonol	3,5,4'-Trihydroxy-7,3'-dimethoxy-6-prenylflavanone
[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe)	Dihydroflavonol	Isotirumalin
[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe)	Dihydroflavonol	Scariosin
[Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe)	Dihydroflavonol	Tirumalin
[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH, 1OMe)	Flavanone	Kenusanone E
[2'-Hydroxychalcone]-A(2OH)-B(1([2,3:@@]-(4-Formyl-5-(p-Hydroxyphenyl)furano)))	2'-Hydroxychalcone	Lophirone D
[Flavanone]-A(1OMe)-B(1([2,3:@@]-(5-(p-Methoxyphenyl)furano)))	Flavanone	Lophirone J
[Flavone]-A(2OH, 1(C-Digitoxopyranosyl))-B(1OH)	Flavone	Torosaflavone A
[Flavone]-A(2OH, 1(C-(beta-D-Oliosyl))-B(1OH)	Flavone	6-C-beta-D-Oliopyranosylapigenin
[Flavone]-A(2OH, 1(C-(beta-D-Boivinosyl))-B(1OH)	Flavone	6-C-beta-D-Boivinopyranosylapigenin
[Flavone]-A(2OH, 1(C-(beta-D-Epioliosyl))-B(1OH)	Flavone	6-C-beta-D-Epioliosylapigenin
[Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)-C(1(O-Angeloyl))	Dihydroflavonol	3,5,7,4'-Tetrahydroxy-8-methoxyflavanone 3-O-angelate
[Flavonol]-A(1OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(none)	Flavonol	8-(2-Carboxy-1-phenylethyl)-3,5,7-trihydroxyflavone delta-lactone
[Flavonol]-A(2OH, 1(3-methylsuccinoyl))-B(1OH)	Flavonol	3,5,7,4'-Tetrahydroxy-8-C-(3-methylsuccinoyl)flavone
[Flavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OMe)	Flavonol	Brevicornin
[Flavonol (3-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OMe, 1([@@]-Methylenedioxy))	Flavonol	3,5,3'-Trimethoxy-6,7:4',5'-bis(methylenedioxy)flavone
[Flavonol (3-OMe)]-A(2OMe, 1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy))	Flavonol	3,5,8-Trimethoxy-6,7:3',4'-bis(methylenedioxy)flavone
[Isoflavanone-3-ol]-A(2OH)-B(2OMe, 1(C-Prenyl))	Isoflavanone-3-ol	Echinoisoflavanone
[Coumestan]-A(1OH)-B(1OH, 1OMe, 1(2,3-Dihydroxy-3-methylbutyl))	Coumestan	Mirificoumestan glycol

Level: 3, プリカーサーm/z: 357.11322

Splash: splash10-0006-0094000000-6bceb3aa339a6782ee53

m/z	Int.	NL	Rel.Int.
243.10	59	114	1000
339.22	10	18	162
315.09	8	42	135
342.84	7	14	122
152.89	5	204	80
322.28	3	35	52

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.286	[Dihydroflavonol]-A(2OH)-B(1OH, 1(C-Prenyl))	Dihydroflavonol	3'-prenylaromadendrin
0.250	[Flavanone]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavanone	Sigmoidin B
0.250	[Flavanone]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavanone	2'-Prenyleriodictyol
0.200	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Dihydroflavonol	Shuterin
0.200	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Dihydroflavonol	8-prenylaromadendrin
0.176	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	6-Prenyleriodictyol
0.176	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	8-Prenyleriodictyol
0.176	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	Leachianone G
0.176	[Flavanone]-A(3OH)-B(1OH, 1(C-Prenyl))	Flavanone	Flowerone
0.176	[Flavanone]-A(3OH, 1(C-Prenyl))-B(1OH)	Flavanone	8-Prenylcarthamidin
0.150	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(3OH)	2'-Hydroxychalcone	Ramosismin
0.111	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavanone	Kievitone
0.111	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavanone	Diphysolone
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH)	2'-Hydroxychalcone	Brosimacutin G
0.000	[Dihydrochalcone]-A(2OH, 1Methyl, 1([2,3:@@]-(4-hydroxy-6,6-Dimethyldihydropyrano)))-B(none)	Dihydrochalcone	2',4',4''-Trihydroxy-3',6'',6''-trimethylpyrano[2'',3'':6',5']dihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 1Methyl, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	Dihydrochalcone	2',4',5''-Trihydroxy-3',6'',6''-trimethylpyrano[2'',3'':6',5']dihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH)	Dihydrochalcone	alpha,beta-Dihydroxanthohumol
0.000	[Dihydrochalcone]-A(3OH, 1OMe, 1(C-Prenyl))-B(none)	Dihydrochalcone	2',4',6'-Trihydroxy-3'-methoxy-5'-prenyldihydrochalcone
0.000	[Flavanone]-A(1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Flavanone	2',4'-Dihydroxy-2''-(1-hydroxy-1-methylethyl)dihydrofuro[2,3-h]flavanone
0.000	[Flavanone]-A(1OH, 1OMe, 1(3-hydroxy-3-methylbutyl))-B(none)	Flavanone	Tephrowatsin C
0.000	[Flavanone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Flavanone	Tomentosanol D
0.000	[Flavanone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(1OH)	Flavanone	5,7,4'-Trihydroxy-8-C-(3-hydroxymethyl-2-butenyl)flavanone
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH)	Flavanone	Phellodensin D
0.000	[Flavanone]-A(2OH, 1(1,1-Dimethylallyl))-B(2OH)	Flavanone	6-(1,1-Dimethylallyl)eriodictyol
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(2OH)	Flavanone	Kenusanone J
0.000	[Flavone]-A(1OH, 1(2,3-Dihydroxy-3-methylbutyl))-B(1OH)	Flavone	Brosimacutin F
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH)	Flavone	Laurifolin (flavonoid)
0.000	[Flavone]-A(2OH, 1(2-Carboxyvinyl))-B(2OH)	Flavone	Demethyltorosaflavone D
0.000	[Flavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavone	5,7,3'-Trimethoxy-4',5'-methylenedioxyflavone
0.000	[Flavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Flavone	Ageconyflavone A
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Dihydroflavonol	3,5,4'-Trihydroxy-4'',5''-dihydro-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
0.000	[Flavonol (3-OMe)]-A(1OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavonol	Kanugin
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 2Methyl)-B(1OMe)	Flavonol	Kalmiatin
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Isokanugin
0.000	[Flavan 3-ol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 3-ol	8-Prenylafzelechin 5-methyl ether
0.000	[Flavan 4-ol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 4-ol	4,5,4'-Trihydroxy-7-methoxy-8-prenylflavan
0.000	[Flavan]-A(2OMe, 1(3-hydroxy-3-methylbutyl))-B(none)	Flavan	Nitenin
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	6,7,3'-Trimethoxy-4',5'-methylenedioxyisoflavone
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Milldurone
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	7,8,2'-Trimethoxy-4',5'-methylenedioxyisoflavone
0.000	[Isoflavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Petalostetin
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	8,3',4'-Trimethoxy-6,7-methylenedioxyisoflavone
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	Hemerocallone
0.000	[Isoflavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Odoratine
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	Iriskumaonin methyl ether
0.000	[Isoflavanone]-A(1OH, 1((Z)-4-hydroxyprenyl))-B(2OH)	Isoflavanone	7,2',4'-Trihydroxy-8-((Z)-4-hydroxyprenyl)isoflavanone
0.000	[Isoflavan]-A(1OH)-B(2OH, 1OMe, 1(1,1-Dimethylallyl))	Isoflavan	alpha,alpha-dimethylallylcyclolobin
0.000	[Coumestan]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Coumestan	2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan
0.000	[6-Hydroxydehydrorotenone]-A(3OH)-B(none)-C(1(O-Acetyl))	6-Hydroxydehydrorotenone	6,9,10,11-Tetrahydroxydehydrorotenone 6-O-acetate
0.000	[4-Hydroxy-3-phenylcoumarin (4-OMe)]-A(2OMe)-B(1([@@]-Methylenedioxy))	4-Hydroxy-3-phenylcoumarin	Derrusnin

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	FS2	FS3	共有数
	32.40	408.14999	7.1021	-0.24	[M+C2H7N+H]+	7-O-Galloyl-sedoheptulose	ALL 1 HM 1				2
2568	32.38	401.04790	0.0000	0.66	[M+K]+	7-O-Galloyl-sedoheptulose	ALL 1 HM 1	MS2 MS3		0.286	2
	32.40	385.07387	-15.9740	-0.14	[M+Na]+	7-O-Galloyl-sedoheptulose	ALL 1 HM 1	MS2	0.040		2
	32.40	380.11848	-20.9294	0.09	[M+NH4]+	7-O-Galloyl-sedoheptulose	ALL 1 HM 1				2
	32.40	363.09181	-37.9561	0.94	[M+H]+	7-O-Galloyl-sedoheptulose	ALL 1 HM 1	MS2 MS3 x 2	0.056		2

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

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