ピーク情報
|
ポプラ, 幼植物, 地上部
pos
|
| Peak #7919 MN MID: SE205_S08_M90 |
| m/z: 591.18639, RT: 72.02, 強度: 1985, ログ強度: -0.30, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 1 |
| DB検索結果: (5 names) Rivulobirin C;Fesumtuorin F;Rivulobirin E;Grape seed extract;Fesumtuorin C |
| DBごとのヒット数: ALL 5 KN 4 HM 1 |
| FlavonoidSearch最大スコア MS2: -, MS3: 0.333 |
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 |
|---|---|---|---|---|
| C32H30O11 | 590.17881 | 0.519 | Rivulobirin C | KNApSAcK: C00031177, C00031178 |
| C32H30O11 | 590.17881 | 0.519 | Fesumtuorin F | KNApSAcK: C00032886, C00037150, C00037151 |
| C32H30O11 | 590.17881 | 0.519 | Grape seed extract | HMDB: HMDB0252936 |
| C32H30O11 | 590.17881 | 0.519 | Rivulobirin E | KNApSAcK: C00031179 |
| C32H30O11 | 590.17881 | 0.519 | Fesumtuorin C | KNApSAcK: C00037147 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 591.18604 |
| Splash: splash10-0udi-0010900000-c70bbf4fa45af28ed65e |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 451.10 | 3226 | 140 | 1000 |
| 289.08 | 519 | 302 | 160 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1(2-Hydroxybenzyl), 1(2x2-hydroxybenzyl))-B(none) | Dihydrochalcone | Triuvaretin |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1(2-Hydroxybenzyl), 1(2x2-hydroxybenzyl))-B(none) | Dihydrochalcone | Isotriuvaretin |
| Level: 3, プリカーサーm/z: 451.09625 |
| Splash: splash10-000i-0090000000-2a27523bd369c53a725d |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 289.01 | 2556 | 162 | 1000 |
| 162.96 | 158 | 288 | 61 |
| 433.11 | 141 | 18 | 55 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavanone]-A(2OH, 1(C-Glu))-B(2OH) | Flavanone | 8-C-Glucopyranosyleriodictylol |
| 0.000 | [Flavanone]-A(2OH, 1(C-Glu))-B(2OH) | Flavanone | 5,7,3',4'-Tetrahydroxyflavanone 6-C-glucoside |
| 0.000 | [Flavone]-A(1OMe, 1([5,4:@@]-(2,2-Dimethyldihydro-3a-acetoxy-3-oxofuro[2,3-c]pyrano)))-B(none) | Flavone | Tephrodin |
| 0.000 | [CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | CCS-type derivative / [2',3]-Prenyloxidoflavone | Dihydrocycloartomunin |
| 0.000 | [CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH) | CCS-type derivative / [2',3]-Prenyloxidoflavone | Cycloaltilisin |
| 0.000 | [CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | CCS-type derivative / [2',3]-Prenyloxidoflavone | Dihydroisocycloartomunin |
| 0.000 | [CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1OMe)-B(2OH, 1(C-Prenyl)) | CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone | Artonin T |
| 0.000 | [Dihydroflavonol]-A(2OH, 1(C-Glu))-B(1OH) | Dihydroflavonol | 6-C-Glucosylaromadendrin |
| 0.000 | [Dihydroflavonol]-A(2OH, 1(C-Glu))-B(1OH) | Dihydroflavonol | 8-C-Glucosylaromadendrin |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH) | Flavonol | Broussoflavonol A |
| 0.000 | [Isoflavone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([@@]-Methylenedioxy)) | Isoflavone | Euchrenone b5 |
| 0.000 | [Isoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe, 1(C-Prenyl)) | Isoflavone | Cajaisoflavone |
| 0.000 | [Isoflavanone]-A(2OH, 1(C-Glu))-B(2OH) | Isoflavanone | Macrocarposide |
| 0.000 | [Coumaranochromon]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl)) | Coumaranochromon | 8-Prenyllisetin |
| Level: 3, プリカーサーm/z: 289.07703 |
| Splash: splash10-00di-0190000000-d4c655b9a0771039579d |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 271.00 | 128 | 18 | 1000 |
| 246.94 | 57 | 42 | 449 |
| 177.05 | 46 | 112 | 356 |
| 243.07 | 21 | 46 | 167 |
| 205.06 | 14 | 84 | 106 |
| 201.03 | 11 | 88 | 89 |
| 203.08 | 8 | 86 | 65 |
| 228.91 | 7 | 60 | 56 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.333 | [Dihydroflavonol]-A(2OH)-B(1OH) | Dihydroflavonol | Aromadendrin |
| 0.250 | [2'-Hydroxychalcone]-A(2OH)-B(3OH) | 2'-Hydroxychalcone | Robtein |
| 0.250 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | Neoplathymenin |
| 0.250 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | Okanin |
| 0.235 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Plathymenin |
| 0.235 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Isookanin |
| 0.214 | [2'-Hydroxychalcone]-A(3OH)-B(2OH) | 2'-Hydroxychalcone | 3,4,2',4',6'-Pentahydroxychalcone |
| 0.200 | [Dihydroflavonol]-A(1OH)-B(2OH) | Dihydroflavonol | Fustin |
| 0.200 | [Dihydroflavonol]-A(2OH)-B(1OH) | Dihydroflavonol | 3,5,7,2'-Tetrahydroxyflavanone |
| 0.200 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | 5,7,2',6'-Tetrahydroxyflavanone |
| 0.200 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | 5,7,2',5'-Tetrahydroxyflavanone |
| 0.200 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Eriodictyol |
| 0.200 | [Flavanone]-A(2OH)-B(2OH) | Flavanone | Steppogenin |
| 0.200 | [Flavanone]-A(3OH)-B(1OH) | Flavanone | Carthamidin |
| 0.200 | [Flavanone]-A(3OH)-B(1OH) | Flavanone | Isocarthamidin |
| 0.133 | [Isoflavanone]-A(2OH)-B(2OH) | Isoflavanone | Dalbergioidin |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(2OH, 1OMe) | Dihydrochalcone | Loureirin D |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(1OH) | Dihydrochalcone | Asebogenin |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(1OH) | Dihydrochalcone | 4,2',4'-Trihydroxy-6'-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(1OH, 1OMe)-B(2OH) | Dihydrochalcone | Dihydrocalythropsin |
| 0.000 | [Dihydrochalcone]-A(2OH)-B(1OH, 1OMe) | Dihydrochalcone | 4,2',4'-Trihydroxy-3-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(3OH)-B(1OMe) | Dihydrochalcone | 2',4',6'-Trihydroxy-4-methoxydihydrochalcone |
| 0.000 | [Auronol]-A(1OH)-B(2OH) | Auronol | 2,6,3',4'-Tetrahydroxy-2-benzylcoumaranone |
| 0.000 | [Auronol]-A(2OH)-B(1OH) | Auronol | Maesopsin |
| 0.000 | [alpha-Hydroxychalcone]-A(2OH)-B(2OH) | alpha-Hydroxychalcone | 3,4,2',4',alpha-Pentahydroxychalcone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(1OH, 1OMe)-B(1OH) | Dihydrochalcone alpha-ol | 4,4',alpha-Trihydroxy-2'-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(2OH)-B(1OMe) | Dihydrochalcone alpha-ol | 2',4',alpha-Trihydroxy-4-methoxydihydrochalcone |
| 0.000 | [2-Hydroxyflavanone]-A(2OH)-B(1OH) | 2-Hydroxyflavanone | 2,5,7,4'-Tetrahydroxyflavanone |
| 0.000 | [CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(2OH)-B(1OH) | CCS-type derivative / [4,2']-Epoxyflavan 3-ol | Cyanomaclurin |
| 0.000 | [CCS-type derivative / [4,2']-Epoxyflavan 3-ol]-A(1OH)-B(2OH) | CCS-type derivative / [4,2']-Epoxyflavan 3-ol | 6,12-Mehthano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol |
| 0.000 | [Flavan]-A(1OH)-B(2OH, 1OMe) | Flavan | 7,3',5'-Trihydroxy-4'-methoxyflavan |