ピーク情報

ミヤコグサ

pos

Peak #7360 MN MID: SE205_S07_M90

m/z: 593.27655, RT: 104.33, 強度: 273868, ログ強度: 1.94, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 9

DB検索結果: (7 names) Pheophorbide a;131-hydroxy-magnesium-protoporphyrin IX 13-monomethyl ester;chlorophyllide a;Pheophorbide a;Scortechinone B;(-)-Scortechinone B;Moreollic acid

DBごとのヒット数: ALL 6 KG 1 KN 2 HM 3

FlavonoidSearch最大スコア MS2: -, 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
C35H36O5N4	592.26857	1.196	Phaeophorbide a	KNApSAcK: C00036413, C00048505
C35H36O5N4	592.26857	1.196	131-hydroxy-magnesium-protoporphyrin IX 13-monomethyl ester	HMDB: [-2f]HMDB0304019
C35H36O5N4	592.26857	1.196	Bacteriochlorophyllide g	KEGG: [-2f]C21441
C35H36O5N4	592.26857	1.196	13(1)-Hydroxy-magnesium-protoporphyrin IX 13-monomethyl ester	KEGG: [-2f]C11829
C35H36O5N4	592.26857	1.196	Chlorophyllide	HMDB: [-2]HMDB0304288 KEGG: [-2f]C02139
C35H36O5N4	592.26857	1.196	Pheophorbide a	HMDB: HMDB0256449 KEGG: C18021
C34H40O9	592.26723	3.454	Scortechinone B	KNApSAcK: C00042968, C00042972
C34H40O9	592.26723	3.454	Moreollic acid	KNApSAcK: C00032031, C00055952

MSnスペクトル情報

Level: 2, プリカーサーm/z: 593.27496

Splash: splash10-001i-0000090000-739f0ae5e4d1bc57bdfd

m/z	Int.	NL	Rel.Int.
533.31	349242	60	1000
534.29	89292	59	255

Level: 3, プリカーサーm/z: 533.29987

Splash: splash10-03di-0000900000-462b20559fb205fcbd93

m/z	Int.	NL	Rel.Int.
461.30	72136	72	1000
462.32	23471	71	325
476.39	18271	57	253
477.29	18119	56	251
460.31	15109	73	209
433.22	10009	100	138
504.34	7227	29	100
505.33	6170	28	85
489.33	5689	44	78
434.40	4972	99	68
474.38	4338	59	60
478.31	3911	55	54
488.34	3810	45	52

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(E)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Isogemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Feruloyl)-(Z)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Gemichalcone C
[2'-Hydroxychalcone]-A(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Acetyl-2,4,6-trihydroxy-5-methylbenzyl))-B(1OH)	2'-Hydroxychalcone	4-Hydroxyrottlerin
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2'',6''-O-diacetate
[Flavone]-A(1OH, 1OMe, 1(1(O-Acetyl)-C-Glu))-B(2OMe)	Flavone	6''-O-Acetylisoorientin 7,3',4'-trimethyl ether
[Flavone]-A(2OH, 1(2(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 2'',6''-O-diacetate
[Flavone]-A(2OH, 1(1(O-<2-Methylbutyroyl>)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-(2'''-methylbutyrate)

Level: 3, プリカーサーm/z: 534.33972

Splash: splash10-03di-0000900000-8ee56caec97a9b1ec289

m/z	Int.	NL	Rel.Int.
462.30	31455	72	1000
461.30	10639	73	338
477.41	9008	57	286
478.35	4987	56	158
434.35	4774	100	151
463.40	4131	71	131
506.39	3438	28	109
505.29	3330	29	105
490.31	2102	44	66
489.40	1829	45	58
433.28	1769	101	56

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果