ピーク情報
|
こごみ 若芽 生
pos
|
| Peak #3546 MN MID: SE115_S060831_M90 |
| m/z: 433.11316, RT: 45.06, 強度: 293613, ログ強度: 1.95, アダクト: [M-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 15 |
| DB検索結果: (43 names) Eriodictyol-8-C-glucoside;2,4,6,4'-Tetrahydroxy-2-benzylcoumaranone 4-O-glucoside;Neocarthamin;2,5,7,4'-Tetrahydroxyflavanone 7-glucoside;Taxifolin 7-rhamnoside;Helicioside A;(+)-Helicioside A;5,7,2',... |
| DBごとのヒット数: ALL 38 KG 3 KN 33 HM 2 |
| FlavonoidSearch最大スコア MS2: 0.714, MS3: 0.056 |
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 |
|---|---|---|---|---|
| C21H22O11 | 450.11621 | 0.515 | 8-C-Glucopyranosyleriodictylol | FlavonoidViewer: FL2FACCS0001 HMDB: HMDB0304673 KNApSAcK: C00006362 LipidMAPS: LMPK12140356 |
| C21H22O11 | 450.11621 | 0.515 | Hovetrichoside C | FlavonoidViewer: FL1BAAGS0001 KNApSAcK: C00014669 LipidMAPS: LMPK12130069 |
| C21H22O11 | 450.11621 | 0.515 | Neocarthamin | FlavonoidViewer: FL2FEAGS0001 HMDB: HMDB0037476 KEGG: C17675 KNApSAcK: C00008231 LipidMAPS: LMPK12140615 |
| C21H22O11 | 450.11621 | 0.515 | 2,5,7,4'-Tetrahydroxyflavanone 7-glucoside | FlavonoidViewer: FL2FHYGS0001 KNApSAcK: C00014328 LipidMAPS: LMPK12140689 |
| C21H22O11 | 450.11621 | 0.515 | Taxifolin 7-rhamnoside | FlavonoidViewer: FL4DACGS0018 KNApSAcK: C00008710 |
| C21H22O11 | 450.11621 | 0.515 | Helicioside A | KNApSAcK: C00035112 |
| C21H22O11 | 450.11621 | 0.515 | Steppogenin 4'-O-beta-D-glucoside | FlavonoidViewer: FL2FALGS0002 KNApSAcK: C00014331 LipidMAPS: LMPK12140460 |
| C21H22O11 | 450.11621 | 0.515 | Rumejaposide D | KNApSAcK: C00034663 |
| C21H22O11 | 450.11621 | 0.515 | Stillopsin | FlavonoidViewer: FL1C2CGS0001 KNApSAcK: C00007913 LipidMAPS: LMPK12120140 |
| C21H22O11 | 450.11621 | 0.515 | Aromadendrin 4'-glucoside | FlavonoidViewer: FL4DAAGS0009 KNApSAcK: C00008677 |
| C21H22O11 | 450.11621 | 0.515 | Isocarthamidin 8-glucoside | FlavonoidViewer: FL2FFAGS0002 KNApSAcK: C00014330 LipidMAPS: LMPK12140665 |
| C21H22O11 | 450.11621 | 0.515 | Aromadendrin 3-glucoside | FlavonoidViewer: FL4DAAGS0002, FL4DAAGS0003 HMDB: HMDB0301924 KNApSAcK: C00008670, C00008671 |
| C21H22O11 | 450.11621 | 0.515 | Marein | FlavonoidViewer: FL1C3CGS0002 HMDB: HMDB0254334 KNApSAcK: C00007893 LipidMAPS: LMPK12120156 |
| C21H22O11 | 450.11621 | 0.515 | Eriodictyol 3'-O-glucoside | FlavonoidViewer: FL2FACGS0006 KNApSAcK: C00008293 LipidMAPS: LMPK12140364 |
| C21H22O11 | 450.11621 | 0.515 | 2,4,6,4'-Tetrahydroxy-2-benzylcoumaranone 6-beta-D-glucopyranoside | FlavonoidViewer: FL1BAAGS0002 HMDB: HMDB0031555 KNApSAcK: C00014670 LipidMAPS: LMPK12130070 |
| C21H22O11 | 450.11621 | 0.515 | Phloretin 2'-O-glucuronide | HMDB: HMDB0041768 |
| C21H22O11 | 450.11621 | 0.515 | Dalbergioidin 4'-O-beta-D-glucopyranoside | KNApSAcK: C00019539 |
| C21H22O11 | 450.11621 | 0.515 | 3,4,2',4',6'-Pentahydroxychalcone 4'-glucoside | FlavonoidViewer: FL1CACGS0002 KEGG: C16408 KNApSAcK: C00007915 LipidMAPS: LMPK12120267 |
| C21H22O11 | 450.11621 | 0.515 | 3,4,2',4',6'-Pentahydroxychalcone 2'-glucoside | FlavonoidViewer: FL1CACGS0001 KNApSAcK: C00007914 LipidMAPS: LMPK12120266 |
| C21H22O11 | 450.11621 | 0.515 | (2R)-5,7,3',4'-Tetrahydroxyflavanone 6-C-glucoside | FlavonoidViewer: FL2FACGS0012, FL2FACGS0013 HMDB: HMDB0304672 KNApSAcK: C00014333, C00014334 LipidMAPS: LMPK12140370, LMPK12140371 |
| C21H22O11 | 450.11621 | 0.515 | 6-C-Glucopyranosyldihydrokaempferol | FlavonoidViewer: FL4DAACS0001 KNApSAcK: C00006089 |
| C21H22O11 | 450.11621 | 0.515 | Sinensin | FlavonoidViewer: FL4DAAGS0006 KNApSAcK: C00008674 |
| C21H22O11 | 450.11621 | 0.515 | Aceronidin | KNApSAcK: C00054707 |
| C21H22O11 | 450.11621 | 0.515 | Stepposide | FlavonoidViewer: FL2FALGS0001 KNApSAcK: C00008368 LipidMAPS: LMPK12140459 |
| C21H22O11 | 450.11621 | 0.515 | Fustin 3-glucoside | FlavonoidViewer: FL4D1CGS0001 KNApSAcK: C00008686 |
| C21H22O11 | 450.11621 | 0.515 | 3,5,7,2',5'-Pentahydroxyflavanone 3-rhamnoside | FlavonoidViewer: FL4DA8GS0001 KNApSAcK: C00008692 |
| C21H22O11 | 450.11621 | 0.515 | Macrocarposide | FlavonoidViewer: FLIBALCS0001 KNApSAcK: C00006120 LipidMAPS: LMPK12050478 |
| C21H22O11 | 450.11621 | 0.515 | Okanin 3'-glucoside | FlavonoidViewer: FL1C3CGS0001 KNApSAcK: C00007892 LipidMAPS: LMPK12120155 |
| C21H22O11 | 450.11621 | 0.515 | (2S)-Eriodictyol 7-O-beta-D-glucopyranoside | FlavonoidViewer: FL2FACGS0004 HMDB: HMDB0029544 KNApSAcK: C00008291 LipidMAPS: LMPK12140362 |
| C21H22O11 | 450.11621 | 0.515 | Cyanidin-3-o-beta-glucopyranoside | HMDB: HMDB0250605 |
| C21H22O11 | 450.11621 | 0.515 | 8-C-Glucosyldihydrokaempferol | FlavonoidViewer: FL4DAACS0002 KNApSAcK: C00014023 |
| C21H22O11 | 450.11621 | 0.515 | Isookaninglucoside | FlavonoidViewer: FL2F3CGS0001 KNApSAcK: C00008282 LipidMAPS: LMPK12140092 |
| C21H22O11 | 450.11621 | 0.515 | (2R,3R)-3,5,7,3',5'-Pentahydroxyflavanone 3-rhamnoside | FlavonoidViewer: FL4DA9GS0002, FL4DA9GS0003, FL4DA9GS0004 KNApSAcK: C00014413, C00014414, C00014415 |
| C21H22O11 | 450.11621 | 0.515 | Astilbin | FlavonoidViewer: FL4DACGS0011, FL4DACGS0012, FL4DACGS0013, FL4DACGS0014 HMDB: HMDB0033850, HMDB0242667 KEGG: C17449, C09803 KNApSAcK: C00008703, C00008704, C00008705, C00008706 LipidMAPS: LMPK12140722 |
| C21H22O11 | 450.11621 | 0.515 | Aspalalinin | KNApSAcK: C00055270 |
| C21H22O11 | 450.11621 | 0.515 | 5,7,2',5'-Tetrahydroxyflavanone 7-glucoside | FlavonoidViewer: FL2FA8GS0004 KNApSAcK: C00014332 LipidMAPS: LMPK12140109 |
| C21H22O11 | 450.11621 | 0.515 | Dihydrorhamnetin 3-O-beta-D-arabinopyranoside | FlavonoidViewer: FL4DBCGS0001 KNApSAcK: C00014412 |
| C21H22O11 | 450.11621 | 0.515 | Eriodictyol 5-O-glucoside | FlavonoidViewer: FL2FACGS0003 KNApSAcK: C00008290 LipidMAPS: LMPK12140361 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 433.11270 |
| Splash: splash10-00xr-0095400000-b3695f97ac6e31aa9c76 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 271.11 | 148796 | 162 | 1000 |
| 415.23 | 78254 | 18 | 525 |
| 367.09 | 39874 | 66 | 267 |
| 337.13 | 27177 | 96 | 182 |
| 397.15 | 15282 | 36 | 102 |
| 313.12 | 14334 | 120 | 96 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.714 | [Flavone]-A(2OH, 1(C-Glu))-B(1OH) | Flavone | Neovitexin |
| 0.714 | [Flavone]-A(2OH, 1(C-Glu))-B(1OH) | Flavone | Vitexin |
| 0.714 | [Flavone]-A(2OH, 1(C-Glu))-B(1OH) | Flavone | Isovitexin |
| 0.714 | [Flavonol]-A(1OH, 1(C-Glu))-B(1OH) | Flavonol | 8-C-Glucosylresokaempferol |
| 0.714 | [Isoflavone]-A(1OH, 1(C-Glu))-B(2OH) | Isoflavone | 8-Glucosyl 3'-hydroxydaidzein |
| 0.714 | [Isoflavone]-A(2OH, 1(C-Glu))-B(1OH) | Isoflavone | Genistein 8-C-glucoside |
| 0.000 | [Flavone]-A(3OMe)-B(4OMe) | Flavone | Agehoustin B |
| 0.000 | [Flavone]-A(4OMe)-B(3OMe) | Flavone | 5,6,7,8,3',4',5'-Heptamethoxyflavone |
| 0.000 | [Flavone]-A(4OMe)-B(3OMe) | Flavone | Agecorynin C |
| 0.000 | [Chalcone]-A(2OMe, 1([@@]-Methylenedioxy))-B(4OMe) | Chalcone | 2,3,4,5,2',6'-Hexamethoxy-3',4'-methylenedioxychalcone |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(4-(p-Hydroxyphenyl)-6-oxodihydropyrano)))-B(1OMe) | Flavanone | Calomelanol G |
| 0.000 | [Flavone]-A(2OH, 1(C-Galactosyl))-B(1OH) | Flavone | 8-C-beta-D-Galactopyranosylapigenin |
| 0.000 | [Flavone]-A(2OH, 1(C-Galactosyl))-B(1OH) | Flavone | 6-C-beta-D-Galactosylapigenin |
| 0.000 | [Flavone]-A(2OH, 1(C-Chinovosyl))-B(2OH) | Flavone | 6-C-Chinovopyranosylluteolin |
| 0.000 | [Flavone]-A(2OH, 1(C-Fucosyl))-B(2OH) | Flavone | 6-C-Fucopyranosylluteolin |
| 0.000 | [Flavone]-A(2OH, 1(C-Rhamnosyl))-B(2OH) | Flavone | 8-C-Rhamnopyranosylluteolin |
| 0.000 | [Flavone]-A(2OH, 1(C-Xylosyl))-B(1OH, 1OMe) | Flavone | 5,7,4'-Trihydroxy-3'-methoxyflavone-8-C-beta-D-xylopyranoside |
| 0.000 | [CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe) | CCS-type derivative / [2',3]-Prenyloxidoflavone | Artocommunol CA |
| 0.000 | [Flavonol (3-OMe)]-A(3OMe)-B(3OMe) | Flavonol | 3,5,6,7,3',4',5'-Heptamethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(3OMe)-B(3OMe) | Flavonol | Benthamitin |
| 0.000 | [Flavonol (3-OMe)]-A(3OMe)-B(3OMe) | Flavonol | Hibiscetin heptamethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(4OMe)-B(2OMe) | Flavonol | 3,5,6,7,8,3',4'-Heptamethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe, 1([@@]-Methylenedioxy))-B(1OH, 2OMe) | Flavonol | 3'-Hydroxy-3,5,8,4',5'-pentamethoxy-6,7-methylenedioxyflavone |
| Level: 3, プリカーサーm/z: 415.23264 |
| Splash: splash10-000i-0009000000-cfe9a190054d5fa514fb |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 337.22 | 34401 | 78 | 1000 |
| 367.19 | 13291 | 48 | 386 |
| 397.21 | 11823 | 18 | 343 |
| 379.11 | 2662 | 36 | 77 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.056 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(3OMe) | Flavanone | Heteroflavanone C |
| 0.000 | [Flavonol]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Flavonol | 3,5,8,4'-Tetrahydroxy-7,3'-dimethoxy-6-(3-methylbut-2''-enyl)flavone |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl), 1(2-Hydroxyethyl))-B(1OH, 1OMe) | Flavanone | Laxiflorin |
| 0.000 | [Flavanone]-A(2OH, 1(1(O-Acetyl)-(E)-4-Hydroxyprenyl))-B(2OH) | Flavanone | Kanzonol S |
| 0.000 | [Flavone]-A(2OH, 1(3,4-Dihydroxy-6-methyl-5-oxotetrahydro-2-pyranyl))-B(1OH) | Flavone | 3'-Deoxyderhamnosylmaysin |
| 0.000 | [Flavone]-A(1OH, 1([2,3:@@]-(8,9-Dihydroxy-7-hydroxymethyl-1,6-dioxaspiro[4,4]non-2-ene)))-B(1OH) | Flavone | Pinnatifinoside A |
| 0.000 | [Flavone]-A(1OH, 1OMe, 1(C-Digitoxopyranosyl))-B(1OH) | Flavone | Aciculatin |
| 0.000 | [Flavone]-A(2OH, 1(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl))-B(1OH) | Flavone | 6-C-(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl)apigenin |
| 0.000 | [4-substituted Flavan 3-ol (4-(2,4,6-Trihydroxyphenyl))]-A(2OH)-B(2OH) | 4-substituted Flavan 3-ol | Prodelphinidin B6 |
| 0.000 | [12a-Hydroxyrotenone]-A(1([2,3:@@]-(5-(2-Hydroxy-1-methylethyl)dihydrofurano)))-B(1OH, 1OMe) | 12a-Hydroxyrotenone | Volubinol |
| Level: 3, プリカーサーm/z: 271.10507 |
| Splash: splash10-00di-0190000000-3061a3613b736a3126a9 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 271.13 | 12477 | -0 | 1000 |
| 152.91 | 1789 | 118 | 143 |
| 242.97 | 630 | 28 | 50 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.182 | [Flavone]-A(2OH)-B(1OH) | Flavone | 5,8,2'-Trihydroxyflavone |
| 0.182 | [Flavone]-A(2OH)-B(1OH) | Flavone | 5,7,2'-Trihydroxyflavone |
| 0.182 | [Flavone]-A(2OH)-B(1OH) | Flavone | Apigenin |
| 0.167 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | Demethyltexasin |
| 0.167 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 8-Hydroxydaidzein |
| 0.167 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 5,7,2'-Trihydroxyisoflavone |
| 0.167 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | 5,7,3'-Trihydroxyisoflavone |
| 0.167 | [Isoflavone]-A(2OH)-B(1OH) | Isoflavone | Genistein |
| 0.143 | [Pterocarpan]-A(1OH)-B(1OMe) | Pterocarpan | Medicarpin |
| 0.143 | [Pterocarpan]-A(1OMe)-B(1OH) | Pterocarpan | Isomedicarpin |
| 0.118 | [Flavonol]-A(2OH)-B(none) | Flavonol | Galangin |
| 0.100 | [Isoflavanone]-A(1OH)-B(1OMe) | Isoflavanone | Dihydroformononetin |
| 0.083 | [Flavone]-A(3OH)-B(none) | Flavone | Baicalein |
| 0.083 | [Flavone]-A(3OH)-B(none) | Flavone | Norwogonin |
| 0.083 | [Flavone]-A(1OH)-B(2OH) | Flavone | 7,3',4'-Trihydroxyflavone |
| 0.083 | [Flavone]-A(1OH)-B(2OH) | Flavone | 5,2',5'-Trihydroxyflavone |
| 0.083 | [Anthocyanidin]-A(2OH)-B(1OH) | Anthocyanidin | Pelargonidin |
| 0.083 | [Chalcone]-A(1OH)-B(1OH, 1OMe) | Chalcone | Echinatin |
| 0.083 | [Chalcone]-A(1OH, 1OMe)-B(1OH) | Chalcone | Isoliquiritigenin 2'-methy ether |
| 0.077 | [Isoflavone]-A(1OH)-B(2OH) | Isoflavone | 3'-Hydroxydaidzein |
| 0.077 | [Isoflavone]-A(1OH)-B(2OH) | Isoflavone | 2'-Hydroxydaidzein |
| 0.053 | [Flavonol]-A(1OH)-B(1OH) | Flavonol | Resokaempferol |
| 0.000 | [Flavanone]-A(1OH)-B(1OMe) | Flavanone | 4'-Methylliquiritigenin |
| 0.000 | [Flavanone]-A(1OMe)-B(1OH) | Flavanone | Methyl-liquiritigenin |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | 7-Hydroxy-8-methoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | Alpinetin |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(none) | Flavanone | Pinostrobin |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1OMe)-B(1OH) | 2'-Hydroxychalcone | Isoliquiritigenin 4'-methyl ether |
| 0.000 | [2'-Hydroxychalcone]-A(2OH)-B(1OMe) | 2'-Hydroxychalcone | Isoliquiritigenin 4-methyl ether |
| 0.000 | [2'-Hydroxychalcone]-A(2OH)-B(1OMe) | 2'-Hydroxychalcone | 2',5'-Dihydroxy-4-methoxychalcone |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Flemichapparin |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Larrein |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | Cardamonin |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(none) | 2'-Hydroxychalcone | 2',6'-Dihydroxy-4'-methoxychalcone |
| 0.000 | [Aurone]-A(1OH)-B(2OH) | Aurone | Sulfuretin |
| 0.000 | [Aurone]-A(2OH)-B(1OH) | Aurone | 4,6,4'-Trihydroxyaurone |
| 0.000 | [UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone (alpha-OMe)]-A(1OMe)-B(none) | UBR-type derivative / 2',5'-Dioxo-3'-cyclopentenyl-type Calcone | Methyllucidone |
| 0.000 | [UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone]-A(3Methyl)-B(none) | UBR-type derivative / 3',5'-Dioxo-1'-cyclopentenyl-type Dihydrocalcone | 4-Hydrocinnamoyl-2,2,5-trimethyl-4-cyclopentene-1,3-dione |
| 0.000 | [Flavanone]-A(2OH, 1Methyl)-B(none) | Flavanone | Strobopinin |
| 0.000 | [Flavanone]-A(2OH, 1Methyl)-B(none) | Flavanone | Cryptostrobin |
| 0.000 | [Flavan]-A(1OMe, 1Methyl)-B(1OH) | Flavan | 4'-Hydroxy-7-methoxy-8-methylflavan |
| 0.000 | [Flavan]-A(1OH)-B(1([@@]-Methylenedioxy)) | Flavan | 7-Hydroxy-3',4'-methylenedioxyflavan |
| 0.000 | [Flavan]-A(2OMe)-B(none) | Flavan | Tephrowatsin E |
| 0.000 | [Flavan]-A(1OH, 1OMe, 1Methyl)-B(none) | Flavan | 7-Hydroxy-5-methoxy-6-methylflavan |
| 0.000 | [3-DehydroxyAnthocyanidin]-A(2OH)-B(2OH) | 3-DehydroxyAnthocyanidin | Luteolinidin |
| 0.000 | [isoflavene]-A(1OH)-B(1OH, 1OMe) | isoflavene | Haginin B |
| 0.000 | [2-Phenylbenzofuran]-A(1OMe)-B(1OH, 1OMe) | 2-Phenylbenzofuran | Vignafuran |
| 0.000 | [2-Phenylbenzofuran]-A(1([@@]-Methylenedioxy))-B(2OH) | 2-Phenylbenzofuran | 2',4'-Dihydroxy-5,6-methylenedioxy-2-phenylbenzofuran |
| 0.000 | [Dalbergiquinol]-A(1OH, 2OMe)-B(none) | Dalbergiquinol | 5-Hydroxy-2,4-dimethoxydalbergiquinol |
| 0.000 | [UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol]-A(1OMe)-B(1OH) | UBR-type derivative / [2,5]-Benzoquinonyl-type Dalbergiquinol | 4'-Hydroxy-4-methoxydalbergione |