ピーク情報

ヒメツリガネゴケ　茎葉体（ガメトフォア）

pos

Peak #4228 MN MID: SE205_S04_M90

m/z: 701.38798, RT: 94.32, 強度: 14209, ログ強度: 0.73, 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: (14 names) 23R,acetoxy-3beta,15alpha,24R,25-tetrahydroxy-cyclo-lanost-7-en-16one-3- O-beta-D-xylopyranoside;Cimiracemoside D;(-)-Cimiracemoside D;Gagunin J;(+)-Gagunin J;Gagunin H;(+)-Gagunin H;Beesioside K;(-)-...

DBごとのヒット数: ALL 8 KN 7 LM 1

FlavonoidSearch最大スコア MS2: -, MS3: 0.056

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
C37H58O11	678.39791	1.252	23R,acetoxy-3beta,15alpha,24R,25-tetrahydroxy-cyclo-lanost-7-en-16one-3- O-beta-D-xylopyranoside	LipidMAPS: LMST01100018
C37H58O11	678.39791	1.252	Cimiracemoside D	KNApSAcK: C00046665
C37H58O11	678.39791	1.252	Gagunin J	KNApSAcK: C00039237
C37H58O11	678.39791	1.252	Gagunin H	KNApSAcK: C00039235
C37H58O11	678.39791	1.252	Beesioside K	KNApSAcK: C00045236
C37H58O11	678.39791	1.252	Hebelomic acid A	KNApSAcK: C00023929
C37H58O11	678.39791	1.252	Cimiracemoside E	KNApSAcK: C00046666
C37H58O11	678.39791	1.252	Cimiracemoside H	KNApSAcK: C00032837

MSnスペクトル情報

Level: 2, プリカーサーm/z: 701.38794

Splash: splash10-0005-0000900000-d78620bed55a1df04850

m/z	Int.	NL	Rel.Int.
449.26	4308	252	1000
493.36	3032	208	703

Level: 3, プリカーサーm/z: 449.25128

Splash: splash10-0udi-0097700000-5a48e6b07ad9e4d7a6d5

m/z	Int.	NL	Rel.Int.
403.33	221	46	1000
287.12	89	162	402
243.09	75	206	337
303.03	73	146	331
421.33	67	28	304
379.22	66	70	297
305.15	64	144	289
277.20	57	172	257
259.02	48	190	219
240.97	42	208	190
383.15	40	66	179
343.39	39	106	174
201.21	29	248	133
245.11	22	204	97
185.06	21	264	95
367.17	12	82	55
418.99	12	30	55

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.037	[Chalcone]-A(4OMe)-B(4OMe)	Chalcone	2,3,4,5,2',3',4',6'-Octamethoxychalcone
0.000	[Flavone]-A(4OMe)-B(1OH, 3OMe)	Flavone	Agehoustin C
0.000	[Anthocyanidin]-A(2OH, 1(C-Glu))-B(2OH)	Anthocyanidin	8-C-Glucosylcyanidin
0.000	[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Isoorientin
0.000	[Flavone]-A(2OH, 1(C-Glu))-B(2OH)	Flavone	Orientin
0.000	[Flavonol]-A(1OH, 1(C-Glu))-B(2OH)	Flavonol	Fisetin 8-C-glucoside
0.000	[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	6-C-Glucopyranosylkaempferol
0.000	[Flavonol]-A(2OH, 1(C-Glu))-B(1OH)	Flavonol	8-C-beta-D-Glucopyranosylkaempferol
0.000	[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	6-C-Glucosylorobol
0.000	[Isoflavone]-A(2OH, 1(C-Glu))-B(2OH)	Isoflavone	8-C-Glucosylorobol
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	6-C-Galactosylluteolin
0.000	[Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH)	Flavone	8-C-Galactosylluteolin
0.000	[Flavone]-A(3OH, 1(C-Galactosyl))-B(1OH)	Flavone	6-C-Galactosylisoscutellarein
0.000	[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloartomunin
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe)	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artomunoxanthone
0.000	[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonol E
0.000	[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Cycloartomunoxanthone
0.000	[UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone	Artonin P
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(1OH, 2OMe)	Flavonol	3'-Hydroxy-3,5,6,7,8,4',5'-heptamethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(3OMe)	Flavonol	5-Hydroxy-3,6,7,8,3',4',5'-heptamethoxyflavone
0.000	[4-Hydroxy-3-phenylcoumarin]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	4-Hydroxy-3-phenylcoumarin	Lonchocarpenin

Level: 3, プリカーサーm/z: 493.36011

Splash: splash10-0f6x-0190000000-40d5d586a36ff4c3cdd7

m/z	Int.	NL	Rel.Int.
202.91	17	290	1000
241.09	15	252	844
259.10	8	234	460
185.22	7	308	381
243.03	4	250	243

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.056	[Flavanone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavanone	Amorisin
0.056	[Flavanone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavanone	Lespedezaflavanone E
0.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 2OMe)	Flavone	Isopyrenin
0.000	[Dihydrochalcone]-A(3OH, 1Geranyl)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Dihydrochalcone	2',4',6',3-Tetrahydroxy-3'-geranyl-6'',6''-dimethylpyrano[2'',3'':4,5]dihydrochalcone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1Geranyl)	Flavanone	Nymphaeol C
0.000	[Flavanone]-A(2OH, 1Farnesyl)-B(2OH)	Flavanone	6-Farnesyl-3',4',5,7-tetrahydroxyflavanone
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Lavandulyl)-B(2OH)	Flavanone	Kushenol B
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Geranyl)-B(2OH)	Flavanone	Macrourone C
0.000	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH, 1Geranyl)	Dihydroflavonol	Sanggenol C
0.000	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH, 1Geranyl)	Isoflavanone	Sophoraisoflavanone D

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MSnスペクトル情報

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