ピーク情報

（なし類）西洋なし生

pos

Peak #689 MN MID: SE123_S070911_M90

m/z: 649.21792, RT: 12.11, 強度: 645682, ログ強度: 2.37, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 150

DB検索結果: (24 names) Lychnose;1F-alpha-D-Galactosylraffinose;Bifurcose;Verbascotetrose;Lychnose;alpha-Isomaltosyl-1,3-isomaltose;Neobifurcose;3-beta-Cellobiosylcellobiose;3-beta-Glucosylcellotriose;Glycogen;Sesamose;Tetra...

DBごとのヒット数: ALL 21 KG 9 KN 3 HM 9

FlavonoidSearch最大スコア MS2: -, MS3: 0.120

DB検索結果

ppm

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
C24H42O21	666.22186	-0.969	Lychnose	KEGG: C08242
C24H42O21	666.22186	-0.969	Verbascotetrose	HMDB: HMDB0303021
C24H42O21	666.22186	-0.969	Bifurcose	HMDB: HMDB0038490 KNApSAcK: C00055238
C24H42O21	666.22186	-0.969	Lychnose	KNApSAcK: C00001139
C24H42O21	666.22186	-0.969	alpha-Isomaltosyl-1,3-isomaltose	KEGG: C21659
C24H42O21	666.22186	-0.969	Neobifurcose	HMDB: HMDB0038870
C24H42O21	666.22186	-0.969	3-beta-Cellobiosylcellobiose	HMDB: HMDB0039174
C24H42O21	666.22186	-0.969	3-beta-Glucosylcellotriose	HMDB: HMDB0039173
C24H42O21	666.22186	-0.969	Glycogen	HMDB: HMDB0000757 KEGG: C00182
C24H42O21	666.22186	-0.969	Tetraglucoside	HMDB: HMDB0258892
C24H42O21	666.22186	-0.969	Sesamose	KEGG: C08248 KNApSAcK: C00001148
C24H42O21	666.22186	-0.969	Cellotetraose	HMDB: HMDB0001296, HMDB0029931, HMDB0252767 KEGG: C02013, C02052, C01810
C24H42O21	666.22186	-0.969	Maltotetraose	KNApSAcK: C00018031
C24H42O21	666.22186	-0.969	Nystose	HMDB: HMDB0039176
C24H42O21	666.22186	-0.969	Schizophyllan	HMDB: HMDB0258177
C24H42O21	666.22186	-0.969	Stachyose	HMDB: HMDB0003553 KEGG: C01613 KNApSAcK: C00001150
C24H42O21	666.22186	-0.969	Sesamose	HMDB: HMDB0038871
C24H42O21	666.22186	-0.969	(1->6)-beta-D-Galactosylgalactogen	KEGG: C04034
C24H42O21	666.22186	-0.969	1,3-alpha-D-Mannosyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose	KEGG: C04861
C24H42O21	666.22186	-0.969	Isolychnose	KEGG: C03989 KNApSAcK: C00050950
C24H42O21	666.22186	-0.969	Fagopyritol B3	HMDB: HMDB0035323, HMDB0040182

MSnスペクトル情報

Level: 2, プリカーサーm/z: 649.21796

Splash: splash10-00di-0029000000-6da7d2a0692b5bbdbf1d

m/z	Int.	NL	Rel.Int.
324.92	1266	324	1000
288.83	274	360	216
271.08	103	378	81
486.76	78	162	61

Level: 3, プリカーサーm/z: 324.96179

Splash: splash10-059i-0390000000-b41822e0e5231ab73c35

m/z	Int.	NL	Rel.Int.
289.07	44	36	1000
271.12	23	54	530
258.71	18	66	410
162.74	16	162	365
144.72	11	180	245
247.29	10	78	230
127.06	9	198	201
307.14	6	18	147
108.72	6	216	129
246.63	5	78	107
223.11	5	102	106
287.69	4	37	87
97.12	4	228	83
213.13	3	112	66

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.120	[2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(none)	2'-Hydroxychalcone	Desmethylisoxanthohumol
0.107	[2'-Hydroxychalcone]-A(2OH)-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Licoagrochalcone A
0.077	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	Glabranin
0.077	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	5,7-Dihydroxy-6-C-prenylflavanone
0.077	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Crotaramosmin
0.069	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Isobavachin
0.069	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Bavachin
0.069	[Flavanone]-A(1OH)-B(1OH, 1(C-Prenyl))	Flavanone	Abyssinone II
0.069	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Isobavachalcone
0.069	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Broussochalcone B
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH)	Pterocarpan	2-Prenyldemethylmedicarpin
0.000	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	8-Prenyldemethylmedicarpin
0.000	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	Phaseollidin
0.000	[Chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Chalcone	Crotmadine
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin E
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin B
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin F
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin C
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Dorsmanin A
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(none)	Dihydrochalcone	1-(2,5-dihydro-6,8-dihydroxy-3-methyl-1-benzoxepin-7-yl)-3-phenyl-1-propanone
0.000	[Flavanone]-A(1OH, 1(3-Hydroxy-3-methyl-1-butenyl))-B(none)	Flavanone	7-Hydroxy-8-C-(3-hydroxy-3-methyl-trans-buten-1-yl)flavanone
0.000	[Flavanone]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	5,6-Dimethoxy-[2'',3'':7,8]furanoflavanone
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(2OMe)	Isoflavanone	Neoraunone
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))	Isoflavan	Crotmarine
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavan	Glabridin
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavan	Phaseollinisoflavan
0.000	[Pterocarpan]-A(1([2,3:@@]-Furano))-B(2OMe)	Pterocarpan	Ambonane
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpan-6a-ol	Neobanol