ピーク情報
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わらび 生わらび 生
pos
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| Peak #7331 MN MID: SE116_S063241_M90 |
| m/z: 453.19059, RT: 82.69, 強度: 3063, ログ強度: -0.01, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2 |
| DB検索結果: (38 names) Bulgarialactone B;3',4'-Dihydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2'''-(1-hydroxy-1-methylethyl)-furano-(4'',5'':6,5)favanone;Broussoflavonol B;Dorsmanin D;3,5,7-Trihydroxy-2-(4-hydroxy-3-methoxyphen... |
| DBごとのヒット数: ALL 24 KG 1 KN 23 |
| FlavonoidSearch最大スコア MS2: -, MS3: - |
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 |
|---|---|---|---|---|
| C26H28O7 | 452.18350 | -0.428 | Bulgarialactone B | KNApSAcK: C00053016 |
| C26H28O7 | 452.18350 | -0.428 | 3',4'-Dihydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2'''-(1-hydroxy-1-methylethyl)-furano-(4'',5'':6,5)favanone | FlavonoidViewer: FL2FCCNF0001 KNApSAcK: C00014214 LipidMAPS: LMPK12140576 |
| C26H28O7 | 452.18350 | -0.428 | Broussoflavonol B | FlavonoidViewer: FL5FDCNI0003 KNApSAcK: C00005032 LipidMAPS: LMPK12112720 |
| C26H28O7 | 452.18350 | -0.428 | Dorsmanin D | FlavonoidViewer: FL5FADNI0002 KNApSAcK: C00013525 LipidMAPS: LMPK12112395 |
| C26H28O7 | 452.18350 | -0.428 | Artonin S | FlavonoidViewer: FL3FRNNI0001 KNApSAcK: C00013504 LipidMAPS: LMPK12111525 |
| C26H28O7 | 452.18350 | -0.428 | Khonklonginol C | KNApSAcK: C00047482 |
| C26H28O7 | 452.18350 | -0.428 | 14-Methoxytajixanthone | KNApSAcK: C00047640 |
| C26H28O7 | 452.18350 | -0.428 | Lupinol B | KNApSAcK: C00019720 |
| C26H28O7 | 452.18350 | -0.428 | Heteroartonin A | FlavonoidViewer: FL3FALNI0020 HMDB: HMDB0041323 KNApSAcK: C00013421 LipidMAPS: LMPK12110909 |
| C26H28O7 | 452.18350 | -0.428 | Artochamin D | KNApSAcK: C00034929 |
| C26H28O7 | 452.18350 | -0.428 | Ligulacephalin B | KNApSAcK: C00031976, C00050607 |
| C26H28O7 | 452.18350 | -0.428 | Derriflavanone | FlavonoidViewer: FL2FAANP0020, FL2FAANP0021 KNApSAcK: C00014259, C00014260 LipidMAPS: LMPK12140325 |
| C26H28O7 | 452.18350 | -0.428 | Tetrapterol F | KNApSAcK: C00018973 |
| C26H28O7 | 452.18350 | -0.428 | 5,7,3',4'-Tetrahydroxy-3-methoxy-6-geranylflavone | KNApSAcK: C00045574 |
| C26H28O7 | 452.18350 | -0.428 | Erythbigenin | KNApSAcK: C00019723 |
| C26H28O7 | 452.18350 | -0.428 | (+)-5,4'-Dihydroxy-6-(3'-methylbut-2''-enyl)-2'''-(4'''-hydroxy-4'''-methylethyl)-3'''-methoxydihydrofurano-[4''',5''' | KNApSAcK: C00047150 |
| C26H28O7 | 452.18350 | -0.428 | Shanciol A | KNApSAcK: C00049013 |
| C26H28O7 | 452.18350 | -0.428 | Sophoronol C | KNApSAcK: C00048130 |
| C26H28O7 | 452.18350 | -0.428 | Chaplashin | KNApSAcK: C00029937 |
| C26H28O7 | 452.18350 | -0.428 | Derrichalcone | FlavonoidViewer: FL1CAANP0003 KNApSAcK: C00007104 LipidMAPS: LMPK12120261 |
| C26H28O7 | 452.18350 | -0.428 | 5,7-Dihydroxy-8-methoxy-3,4'-diprenyloxyflavone | FlavonoidViewer: FL5FFANI0003 KNApSAcK: C00005007 LipidMAPS: LMPK12113145 |
| C26H28O7 | 452.18350 | -0.428 | Erysengalensein C | KNApSAcK: C00018996 |
| C27H24O3N4 | 452.18484 | -3.386 | 3'-Demethylstaurosporine | KEGG: C07349 KNApSAcK: C00016476 |
| C27H24O3N4 | 452.18484 | -3.386 | Okaramine I | KNApSAcK: C00026926 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 453.19061 |
| Splash: splash10-0udi-0090000000-dce2e84d9d07f01cbb83 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 201.07 | 5194 | 252 | 1000 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavonol]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe) | Flavonol | Dorsmanin D |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 2(C-Prenyl))-B(1OH, 1OMe) | Flavanone | Amoradinin |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydro-4-hydroxy-5-methoxypyrano)))-B(1OH) | 2'-Hydroxychalcone | Derrichalcone |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe, 1Lavandulyl)-B(1OH, 1OMe) | 2'-Hydroxychalcone | Kushenol D |
| 0.000 | [Dihydrochalcone]-A(2OH, 1(2-Hydroxybenzyl), 1([2,3:@@]-(4-hydrochromeno)))-B(none) | Dihydrochalcone | Chamuvaritin |
| 0.000 | [Dihydrochalcone]-A(3OH, 1(C-Glu))-B(2OH) | Dihydrochalcone | Aspalathin |
| 0.000 | [Dihydrochalcone alpha-ol]-A(2OH, 1(C-Glu))-B(2OH) | Dihydrochalcone alpha-ol | Coatline B |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(3-Methoxy-4,4-dimethyl-2-oxetanylmethyl))-B(1OH) | Flavanone | Derriflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(1OH, 1OMe) | Flavanone | 2'-Methoxykurarinone |
| 0.000 | [Flavanone]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(5-(Hydroxyisopropanyl)furano)))-B(2OH) | Flavanone | 3',4'-Dihydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2'''-(1-hydroxy-1-methylethyl)-furano-(4'',5'':6,5)favanone |
| 0.000 | [Flavone]-A(1OMe, 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydro-4,5-diacetoxypyrano)))-B(none) | Flavone | 9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one |
| 0.000 | [Flavone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-4,5-dihydroxydihydropyrano))) | Flavone | Epimedokoreanin A |
| 0.000 | [3-substituted Flavone (3-C-Prenyl)]-A(2OH)-B(2OH, 1OMe, 1(C-Prenyl)) | 3-substituted Flavone | Heteroartonin A |
| 0.000 | [CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH) | CCS-type derivative / [2',3]-(Epoxy-1-hydroxyisopropanylethano)flavone | Artonin S |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2(C-Prenyl))-B(2OH) | Flavonol | Broussoflavonol B |
| 0.000 | [Flavan 3-ol]-A(2OH, 1(C-Glu))-B(2OH) | Flavan 3-ol | 6-C-Glucopyranosylcatechin |
| 0.000 | [Flavan 3-ol]-A(2OH, 1(C-Glu))-B(2OH) | Flavan 3-ol | 8-C-Glucopyranosylcatechin |
| 0.000 | [Flavan 3-ol]-A(2OH, 1(C-Galactosyl))-B(2OH) | Flavan 3-ol | Catechin 8-C-beta-D-galactoside |
| 0.000 | [Flavan 3-ol]-A(1OH, 1([2,3:@@]-(4-(3,4-Dihydroxyphenyl)-6-oxodihydropyrano)))-B(2OH) | Flavan 3-ol | Cinchonain Ib |
| 0.000 | [Flavan 3-ol]-A(1OH, 1([2,3:@@]-(4-(3,4-Dihydroxyphenyl)-6-oxodihydropyrano)))-B(2OH) | Flavan 3-ol | Cinchonain Ic |
| 0.000 | [Flavan 3-ol]-A(2OH)-B(3OH)-C(1(O-p-Coumaroyl)) | Flavan 3-ol | Gallocatechin 3-O-p-coumarate |
| Level: 3, プリカーサーm/z: 201.08664 |
| Splash: splash10-0089-0900000000-cc94f64e87b962ba9639 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 183.11 | 900 | 18 | 1000 |
| 173.16 | 588 | 28 | 653 |
| 168.06 | 351 | 33 | 390 |
| 159.10 | 198 | 42 | 219 |
| 155.03 | 115 | 46 | 128 |
| 145.01 | 100 | 56 | 111 |
| 157.09 | 92 | 44 | 102 |
| 171.06 | 71 | 30 | 78 |
| 186.08 | 70 | 15 | 78 |
| 131.07 | 68 | 70 | 75 |
| 143.08 | 49 | 58 | 54 |
| 158.04 | 45 | 43 | 50 |
FlavonoidSearch結果
ヒットなし
関連ピーク情報
| ピーク番号 | 保持時間 (min) | m/z | m/z差分 | ログ強度 | アダクト | DB検索結果 | ヒット数 | MSn | FS2 | FS3 | N原子数 | S原子数 | 共有数 |
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