ピーク情報

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Peak #7209 MN MID: SE199_S41_M90

m/z: 701.18707, RT: 74.97, 強度: 11572, ログ強度: 0.47, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: Paulomycin E

DBごとのヒット数: ALL 1 KN 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.037

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
C29H36O16N2S	700.17855	1.774	Paulomycin E	KNApSAcK: C00017887

MSnスペクトル情報

Level: 2, プリカーサーm/z: 701.18671

Splash: splash10-0a4i-0002090000-21ddc9a92eab2e47bf6b

m/z	Int.	NL	Rel.Int.
507.16	4483	194	1000
371.26	1342	330	299
537.23	490	164	109

Level: 3, プリカーサーm/z: 507.12018

Splash: splash10-004i-0007900000-71a6fcae19118bc819c3

m/z	Int.	NL	Rel.Int.
475.20	1491	32	1000
327.13	799	180	535
354.95	400	152	268
329.04	135	178	90
479.32	106	28	70

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.037	[Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 2(C-Prenyl))	Flavonol	Broussoflavonol G
0.037	[Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 2(C-Prenyl))	Flavonol	Petalostemumol G
0.000	[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	Amoritin
0.000	[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	Isoamoritin
0.000	[Dihydrochalcone]-A(1OH, 1OMe, 1([2,3:@@]-(5-(hydroxyisopropyl)-4-(5-methoxycarbonyl-2-hydroxyPhenyl)-4,5-dihydrofurano)))-B(none)	Dihydrochalcone	Piperaduncin B
0.000	[Flavanone]-A(1OH, 1Methyl, 1([2,3:@@]-(8a-Hydroxy-4-Isopropyl-6,6,8,8-tetramethyl-5,7-dioxy-4,4a,8,8a-tetrahydrochromeno)))-B(none)	Flavanone	Lumaflavanone C
0.000	[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Flavanone	Flemichin E
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Lavandulyl)-B(3OH)	Flavanone	Exiguaflavanone H
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1Lavandulyl)-B(3OH)	Flavanone	Exiguaflavanone I
0.000	[3-substituted Flavone (3-C-Prenyl)]-A(2OH, 1(C-Prenyl), 1(2-hydroxy-3-methyl-3-butenyl))-B(2OH)	3-substituted Flavone	Dorsilurin D
0.000	[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Flavone	Artelastofuran
0.000	[Flavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(2OH)	Flavone	Dorsilurin B
0.000	[CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(2OH, 2(C-Prenyl))-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone	Artelastocarpin
0.000	[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(none)-B(1Geranyl)	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sanggenol G
0.000	[CCS-type derivative / [3,2']-Epoxy-2-farnesylflavanone]-A(2OH)-B(1OH)	CCS-type derivative / [3,2']-Epoxy-2-farnesylflavanone	Sanggenol H
0.000	[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(1Geranyl)-B(none)	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sanggenol I
0.000	[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein F
0.000	[CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone]-A(2OH, 2(C-Prenyl))-B(1OH)	CCS-type derivative / [3,2']-Epoxy-2-prenyl-3-hydroxyflavanone	Sorocein G
0.000	[Flavonol]-A(2OH, 1(1,1-Dimethylallyl))-B(2OH, 2(C-Prenyl))	Flavonol	Broussoflavonol C
0.000	[Flavonol]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))	Flavonol	Broussoflavonol E

Level: 3, プリカーサーm/z: 371.22467

Splash: splash10-0fb9-0900000000-35f7d7449aab8d1dcf08

m/z	Int.	NL	Rel.Int.
176.91	269	194	1000
151.03	155	220	576
147.02	110	224	407
144.92	67	226	250
181.06	49	190	183
122.89	15	248	54
343.28	14	28	50

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.105	[Isoflavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl))	Isoflavanone	3S-5,7,3'-Trihydroxy-4'-methoxy-5'-prenylisoflavanone
0.105	[Isoflavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl))	Isoflavanone	Sophoraisoflavanone A
0.100	[Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	Flavanone	Exiguaflavanone K
0.050	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	Isoflavanone	4'-O-Methylkievitone
0.050	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	Isoflavanone	Diphysolidone
0.048	[Flavanone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavanone	Dioflorin
0.034	[Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavonol	Gancaonin P
0.034	[Flavonol]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavonol	2'-Prenylrhynchosin
0.034	[Flavonol]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavonol	Uralenol
0.000	[Flavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe)	Flavone	Torosaflavone D
0.000	[Dihydroflavonol]-A(2OH, 1OMe, 1(C-Prenyl))-B(none)	Dihydroflavonol	Dioclenol
0.000	[Flavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	5'-Prenylhomoeriodictyol
0.000	[Flavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl))	Flavanone	4'-Methylsigmoidin B
0.000	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH)	Flavanone	5,3',4'-Trihydroxy-7-methoxy-8-C-prenylflavanone
0.000	[Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH)	Flavanone	Kenusanone I
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1(2-Hydroperoxy-3-methyl-3-butenyl))-B(1OH)	2'-Hydroxychalcone	Xanthoangelol E
0.000	[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	2'-Hydroxychalcone	Xanthohumol D
0.000	[2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Dehydrocycloxanthohumol hydratechalcone
0.000	[Dihydrochalcone]-A(1OH, 2OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Dihydrochalcone	2'-Hydroxy-5',6'-dimethoxy-3,4-methylenedioxyfurano[2'',3'':4',3'] dihydrochalcon
0.000	[Flavanone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OMe)	Flavanone	5,7-Dihydroxy-4'-methoxy-8-C-(2-hydroxy-3-methyl-3-butenyl)flavanone
0.000	[Flavanone]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH, 1OMe)	Flavanone	5,7,4'-Trihydroxy-3'-methoxy-6-(1,1-dimethylallyl)flavanone
0.000	[Flavone]-A(2OH, 1(3-Hydroxy-3-methyl-1-butenyl))-B(2OH)	Flavone	Oxidihydroartocarpesin
0.000	[Dihydroflavonol]-A(1OH, 1OMe, 1Methyl)-B(1OH)	Dihydroflavonol	5,7,4'-Trihydroxy-5-methoxy-8-prenylflavanone
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(2OH)	Dihydroflavonol	7,8-Dihydrooxepinodihydroquercetin
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH)	Dihydroflavonol	Shuterone A
0.000	[Flavonol]-A(2OH)-B(1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))	Flavonol	Glycyrrhiza flavonol A
0.000	[Flavonol (3-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy))	Flavonol	Meliternatin
0.000	[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	CCS-type derivative / [3,2']-Epoxymethanoflavone	6-Methoxypulcherrimin
0.000	[Flavan 3,4-diol]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	Flavan 3,4-diol	4beta-Hydroxyobovatachromene
0.000	[Flavan 3,4-diol]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Flavan 3,4-diol	3,4,5,6-Tetramethoxyfurano[2,3-h]flavan
0.000	[Flavan 3,4-diol]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Flavan 3,4-diol	Diplotropin
0.000	[Isoflavone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(2OH)	Isoflavone	2,3-Dehydrokievitol
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Isoflavone	Lunatone
0.000	[Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Isoflavone	Lupinisoflavone B
0.000	[Isoflavone]-A(2OH)-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))	Isoflavone	Lupinisoflavone D
0.000	[Isoflavan]-A(1OH)-B(1OH, 2OMe, 1(1,1-Dimethylallyl))	Isoflavan	Unanisoflavan
0.000	[Pterocarpan-6a-ol]-A(1OH)-B(1OH, 1OMe, 1(C-Prenyl))	Pterocarpan-6a-ol	Sphenostylin B
0.000	[6-Oxodehydrorotenone]-A(1OH, 1OMe)-B(2OMe)	6-Oxodehydrorotenone	Stemonone