ピーク情報

パセリ　葉

pos

Peak #8842 MN MID: SE61_S21_M90

m/z: 487.28987, RT: 72.82, 強度: 86849, ログ強度: 1.35, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (8 names) DG(2:0/0:0/6 keto-PGF1alpha);DG(2:0/TXB2/0:0);10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside;DG(2:0/6 keto-PGF1alpha/0:0);DG(2:0/0:0/TXB2);DG(TXB2/2:0/0:0);1-(7Z,10Z,13Z-hexadecatrien...

DBごとのヒット数: ALL 8 KN 1 HM 6 LM 1

FlavonoidSearch最大スコア MS2: 0.100, MS3: -

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
C25H42O9	486.28288	-0.593	DG(2:0/0:0/6 keto-PGF1alpha)	HMDB: HMDB0296913, HMDB0296914
C25H42O9	486.28288	-0.593	DG(2:0/TXB2/0:0)	HMDB: HMDB0296931
C25H42O9	486.28288	-0.593	10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside	KNApSAcK: C00019369
C25H42O9	486.28288	-0.593	DG(2:0/6 keto-PGF1alpha/0:0)	HMDB: HMDB0296911
C25H42O9	486.28288	-0.593	DG(2:0/0:0/TXB2)	HMDB: HMDB0296933, HMDB0296934
C25H42O9	486.28288	-0.593	DG(TXB2/2:0/0:0)	HMDB: HMDB0296932
C25H42O9	486.28288	-0.593	1-(7Z,10Z,13Z-hexadecatrienoyl)-3-O-beta-D-galactosyl-sn-glycerol	LipidMAPS: LMGL04010009
C25H42O9	486.28288	-0.593	DG(6 keto-PGF1alpha/2:0/0:0)	HMDB: HMDB0296912

MSnスペクトル情報

Level: 2, プリカーサーm/z: 487.28934

Splash: splash10-014i-0003900000-e3802bc88326c331a900

m/z	Int.	NL	Rel.Int.
469.30	819	18	1000
395.31	138	92	168
433.35	117	54	143
325.20	111	162	135
451.24	102	36	124
391.23	84	96	103
307.29	51	180	62

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavan 3-ol]-A(2OH)-B(3OH)-C(1(O-2(OMe)-Galloyl))	Flavan 3-ol	Gallocatechin 3-O-(3,5-di-O-methylgallate)
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Coumaroyl)-(E)-4-hydroxyprenyl))-B(1OH)	2'-Hydroxychalcone	Isogemichalcone B
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Coumaroyl)-(Z)-4-hydroxyprenyl))-B(1OH)	2'-Hydroxychalcone	Gemichalcone B
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Artelastochromene

Level: 3, プリカーサーm/z: 469.30133

Splash: splash10-0udi-0136900000-1c554d782964d7544f25

m/z	Int.	NL	Rel.Int.
451.41	95	18	1000
377.45	32	92	333
433.35	31	36	323
391.32	21	78	218
289.19	17	180	181
415.49	14	54	145
359.09	13	110	135
211.17	11	258	117
349.14	10	120	105
441.68	10	28	104
307.37	9	162	99
269.34	9	200	98
159.15	9	310	96
373.09	9	96	90
161.05	9	308	90
353.30	8	116	80
341.18	8	128	79
283.17	7	186	75
215.28	7	254	73
229.35	7	240	73

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavanone]-A(2OH, 1(2-Hydroxybenzyl), 1(2-Hydroxybenzyl))-B(none)	Flavanone	Dichamanetin
[Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(2OH, 1OMe)	Flavanone	Exiguaflavanone E
[CCS-type derivative / [2',3]-(Epoxy-1-hydroperoxyisopropanylethano)flavone]-A(1OH, 1OMe)-B(1OH)	CCS-type derivative / [2',3]-(Epoxy-1-hydroperoxyisopropanylethano)flavone	Artoindonesianin B
[Flavan 3-ol]-A(2OH)-B(3OH)-C(1(O-Caffeoyl))	Flavan 3-ol	Gallocatechin 3-O-caffeate
[Flavan 3-ol]-A(1OH, 1([2,3:@@]-(4-(3,4-Dihydroxyphenyl)-6-oxodihydropyrano)))-B(3OH)	Flavan 3-ol	Apocynin A
[Isoflavone]-A(1OH, 1(3-Hydroxy-3-methylbutyl), 11([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(2OMe)	Isoflavone	1'',2''-Dihydro-8-hydroxyisopentanyl-3'-methoxy-4'-O-methylalpinumisoflavone
[Isoflavone]-A(1OH, 1(3-Hydroxy-3-methylbutyl), 11([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(2OMe)	Isoflavone	1'',2''-Dihydro-8-hydroxyisopentanyl-2'-methoxy-4'-O-methylalpinumisoflavone

関連ピーク情報

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
	72.86	525.24572	37.9559	1.03	[M+K]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3			4
	72.88	509.27193	21.9821	0.98	[M+Na]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3	0.100		4
	72.80	504.31638	17.0265	1.25	[M+NH4]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3			6
8842	72.82	487.28987	0.0000	1.35	[M+H]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3	0.100		3
	72.81	469.27924	-18.0106	1.44	[M-H2O+H]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3 x 2		0.038	5

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

関連ピーク情報