ピーク情報

シロイヌナズナ 地上部
  pos
Peak #1168  MN MID: SE200_S1_M90
m/z: 360.14975,   RT: 13.38,   強度: 64300,   ログ強度: 1.18,   アダクト: [M+NH4]+,   共有数(同様のピークを含むサンプル数): 14
        
DB検索結果: (25 names) Lactulose;Sakebiose;Nigerose;Inulobiose;Trehalose;Turanose;Gentiobiose;Isomaltulose;Sakebiose;Lactose;Melibiose;Sophorose;Trehalulose;Kojibiose;Sucrose;Maltulose;4-O-alpha-D-Glucopyranosyl-D-fructose;...
DBごとのヒット数: ALL 23 KG 15 KN 4 HM 4
FlavonoidSearch最大スコア MS2: -,   MS3: 0.091

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
C12H22O11 342.11621 -0.850 Lactulose HMDB: HMDB0000740
KEGG: C07064
C12H22O11 342.11621 -0.850 Sakebiose HMDB: HMDB0006603HMDB0259415
KNApSAcK: C00050493
C12H22O11 342.11621 -0.850 Inulobiose HMDB: HMDB0029898HMDB0304763
KEGG: C01711
C12H22O11 342.11621 -0.850 Trehalose HMDB: HMDB0000975HMDB0029880
KEGG: C01083
KNApSAcK: C00001152
C12H22O11 342.11621 -0.850 Gentiobiose HMDB: HMDB0259486
KNApSAcK: C00018660C00053253
C12H22O11 342.11621 -0.850 Turanose HMDB: HMDB0011740HMDB0260157
KEGG: C19636
KNApSAcK: C00053105
C12H22O11 342.11621 -0.850 Melibiulose HMDB: HMDB0247101
KEGG: C19634
KNApSAcK: C00053368
C12H22O11 342.11621 -0.850 Nigerose HMDB: HMDB0029882HMDB0060068HMDB0242694
KEGG: C01518C02048C04147C19773C22512
KNApSAcK: C00001137
C12H22O11 342.11621 -0.850 beta-Lactose HMDB: HMDB0000055HMDB0000163HMDB0000186HMDB0029902HMDB0029933HMDB0033368HMDB0037138HMDB0041627HMDB0246552
KEGG: C01970C01971C06422C20861C00185C00208C00897C02964C00243C06421C20236C22492
KNApSAcK: C00001134C00001136C00001140C00050427
C12H22O11 342.11621 -0.850 Melibiose HMDB: HMDB0000048HMDB0002923HMDB0006792HMDB0038489HMDB0248216
KEGG: C00252C01728C05402C08240C05400
KNApSAcK: C00001142
C12H22O11 342.11621 -0.850 Sophorose HMDB: HMDB0252573
KEGG: C08250C15548C22632C21336
KNApSAcK: C00001149
C12H22O11 342.11621 -0.850 Trehalulose HMDB: HMDB0039727
C12H22O11 342.11621 -0.850 Kojibiose HMDB: HMDB0011742
KEGG: C19632
KNApSAcK: C00050477
C12H22O11 342.11621 -0.850 Sucrose HMDB: HMDB0000258HMDB0246276
KEGG: C00089C18068C04219
KNApSAcK: C00001151
C12H22O11 342.11621 -0.850 Maltulose KEGG: C19633
C12H22O11 342.11621 -0.850 beta-D-Galf-(1->5)-beta-D-galactofuranoside KEGG: C22958
C12H22O11 342.11621 -0.850 (3S,4R,5S)-3,4,5,6-Tetrahydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-one HMDB: HMDB0260158
C12H22O11 342.11621 -0.850 Palatinose HMDB: HMDB0256083
KEGG: C01742
C12H22O11 342.11621 -0.850 4-O-beta-D-Mannopyranosyl-D-mannose HMDB: HMDB0242553
KNApSAcK: C00053459
C12H22O11 342.11621 -0.850 Difructan KNApSAcK: C00055102
C12H22O11 342.11621 -0.850 Galactinol HMDB: HMDB0005826HMDB0039876
KEGG: C01235
KNApSAcK: C00001162C00038295
C12H22O11 342.11621 -0.850 Levanbiose KEGG: C01725
C12H22O11 342.11621 -0.850 Glucinol HMDB: HMDB0039237
C12H22O11 342.11621 -0.850 Maltulose HMDB: HMDB0029919

MSnスペクトル情報

Level: 2,  プリカーサーm/z: 360.14941
Splash: splash10-00dl-0009000000-4c369eda40fada695152
0100200300m/z02004006008001,000Int.
m/z Int. NL Rel.Int.
324.91 2559 35 1000
342.97 1550 17 605
342.34 631 18 246
180.10 315 180 123
288.77 299 71 116
306.41 185 54 72
307.10 129 53 50

FlavonoidSearch結果

ヒットなし

Level: 3,  プリカーサーm/z: 324.90643
Splash: splash10-06rl-0940000000-81afee241bbbd156ff20
0100200300m/z02004006008001,000Int.
m/z Int. NL Rel.Int.
288.81 23 36 1000
162.86 19 162 820
144.86 18 180 772
108.68 8 216 365
126.80 5 198 217
307.13 4 18 154
96.77 2 228 102

FlavonoidSearch結果

Score Symbolized Name MSMS-Category MSMS-Aglycone
0.091 [2'-Hydroxychalcone]-A(2OH)-B(1OH, 1(C-Prenyl)) 2'-Hydroxychalcone Licoagrochalcone A
0.050 [Flavanone]-A(2OH, 1(C-Prenyl))-B(none) Flavanone Glabranin
0.050 [Flavanone]-A(2OH, 1(C-Prenyl))-B(none) Flavanone 5,7-Dihydroxy-6-C-prenylflavanone
0.050 [Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH) Flavanone Crotaramosmin
0.050 [2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(none) 2'-Hydroxychalcone Desmethylisoxanthohumol
0.043 [Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH) Flavanone Isobavachin
0.043 [Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH) Flavanone Bavachin
0.043 [Flavanone]-A(1OH)-B(1OH, 1(C-Prenyl)) Flavanone Abyssinone II
0.043 [2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH) 2'-Hydroxychalcone Isobavachalcone
0.043 [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

Level: 3,  プリカーサーm/z: 342.96869
Splash: splash10-0006-0009000000-51c44aefcb0de1ebaaf3
0100200300m/z02004006008001,000Int.
m/z Int. NL Rel.Int.
342.50 3 0 1000

FlavonoidSearch結果

Score Symbolized Name MSMS-Category MSMS-Aglycone