ピーク情報
|
細ネギ （若香）地下部
pos
|
| Peak #2423 MN MID: SE201_S21_M90 |
| m/z: 377.14535, RT: 38.11, 強度: 28478, ログ強度: 0.87, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 8 |
| DB検索結果: (18 names) Riboflavin;Euphroside;loganate;Cachineside V;Tecomoside;6beta-Dihydrocornic acid;4-Methylantirrhinoside;;Junipetrioloside B;Vebraside;Tuliposide D;9-Hydroxysemperoside;(1x,2x)-Guaiacylglycerol 2-gluco... |
| DBごとのヒット数: ALL 17 KG 2 KN 12 HM 3 |
| FlavonoidSearch最大スコア MS2: 0.083, MS3: 0.107 |
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 |
|---|---|---|---|---|
| C17H20O6N4 | 376.13828 | -0.555 | Riboflavin | HMDB: HMDB0000244, HMDB0247501 KEGG: C00255 KNApSAcK: C00001552 |
| C16H24O10 | 376.13695 | 3.001 | Euphroside | KNApSAcK: C00010508 |
| C16H24O10 | 376.13695 | 3.001 | Loganate | HMDB: HMDB0247433, [-1]HMDB0304409 KEGG: C01512, C11661 KNApSAcK: C00010604, C00029601, C00033820, C00036652 LipidMAPS: LMPR01020138 |
| C16H24O10 | 376.13695 | 3.001 | Cachineside V | KNApSAcK: C00010506 |
| C16H24O10 | 376.13695 | 3.001 | Tecomoside | KNApSAcK: C00010710 |
| C16H24O10 | 376.13695 | 3.001 | 6beta-Dihydrocornic acid | KNApSAcK: C00036611 |
| C16H24O10 | 376.13695 | 3.001 | 4-Methylantirrhinoside | KNApSAcK: C00010614 |
| C16H24O10 | 376.13695 | 3.001 | KNApSAcK: C00010472 |
|
| C16H24O10 | 376.13695 | 3.001 | Junipetrioloside B | KNApSAcK: C00036329, C00041025 |
| C16H24O10 | 376.13695 | 3.001 | Tuliposide D | KNApSAcK: C00040581 |
| C16H24O10 | 376.13695 | 3.001 | Vebraside | KNApSAcK: C00010725 |
| C16H24O10 | 376.13695 | 3.001 | (1x,2x)-Guaiacylglycerol 2-glucoside | HMDB: HMDB0033301 |
| C16H24O10 | 376.13695 | 3.001 | 9-Hydroxysemperoside | KNApSAcK: C00010681 |
| C16H24O10 | 376.13695 | 3.001 | (1RS,2RS)-Guaiacylglycerol 1-glucoside | HMDB: HMDB0033300 |
| C16H24O10 | 376.13695 | 3.001 | Mussaenosidic acid | KNApSAcK: C00010629 |
| C16H24O10 | 376.13695 | 3.001 | (1x,2x)-Guaiacylglycerol 3-glucoside | HMDB: HMDB0040600 |
| C16H24O10 | 376.13695 | 3.001 | 6-O-Methyl catalpol | KNApSAcK: C00010518 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 377.14490 |
| Splash: splash10-0006-0091000000-c060726445cbea21e98d |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 243.07 | 163400 | 134 | 1000 |
| 359.17 | 24417 | 18 | 149 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.083 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 2OMe) | Flavanone | 5,3'-Dihydroxy-6,7,4',5'-tetramethoxyflavanone |
| 0.083 | [Flavanone]-A(1OH, 3OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-6,7,8,6'-tetramethoxyflavanone |
| 0.056 | [Flavanone]-A(1OH, 2(C-Prenyl))-B(none) | Flavanone | Ovaliflavanone A |
| 0.056 | [2'-Hydroxychalcone]-A(2OH, 2(C-Prenyl))-B(none) | 2'-Hydroxychalcone | Spinochalcone A |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',6'-Tetrahydroxy-6,8,2'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',4'-Tetrahydroxy-6,8,5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',4'-Tetrahydroxy-6,8,5'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavonol | Limocitrol |
| 0.000 | [Flavonol]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavonol | 3,5,7,3'-Tetrahydroxy-6,8,4'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(1OH, 3OMe)-B(2OH) | Flavonol | 3,5,3',4'-Tetrahydroxy-6,7,8-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavonol | 3,5,7,4'-Tetrahydroxy-6,3',5'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavonol | 3,5,7,3'-Tetrahydroxy-6,4',5'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavonol | Hibiscetin 8,3',5'-trimethyl ether |
| 0.000 | [Pterocarpan]-A(1OH, 2OMe)-B(1OH, 2OMe) | Pterocarpan | 2,8-Dihydroxy-3,4,9,10-tetramethoxypterocarpan |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1(2-hydroxybenzyl))-B(none) | Flavanone | 5-O-Methylchamanetin |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(none)-C(1(O-Benzoyl)) | Dihydroflavonol | Pinobanksin 3-O-benzoate |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe)-B(2OH)-C(1(O-Acetyl)) | Dihydroflavonol | 3,5,7,3',4'-Pentahydroxy-6-methoxyflavanone 3-O-acetate |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe, 1([@@]-Methylenedioxy))-B(1OH, 1OMe) | Dihydroflavonol | Plumbaginol |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 2OMe) | Flavonol | 5,6,7,4'-Tetrahydroxy-3,3',5'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,3',5'-Tetrahydroxy-3,6,4'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,3',4'-Tetrahydroxy-3,6,5'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Apuleisin |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,4',5'-Tetrahydroxy-3,6,2'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,2',5'-Tetrahydroxy-3,6,4'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,2',4'-Tetrahydroxy-3,6,5'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Hibiscetin 3,7,4'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Hibiscetin 3,8,4'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 5,7,2',4'-Tetrahydroxy-3,8,5'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH) | Flavonol | 5,7,3',4'-Tetrahydroxy-3,6,8-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2OMe)-B(2OH) | Flavonol | 5,6,3',4'-Tetrahydroxy-3,7,8-trimethoxyflavone |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(1OH, 2OMe)-B(2OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Abruquinone C |
| 0.000 | [Dehydrorotenone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1([@@]-Methylenedioxy)) | Dehydrorotenone | Dehydromillettone |
| Level: 3, プリカーサーm/z: 243.06677 |
| Splash: splash10-0fdk-0950000000-3210f4f585b64c8236fd |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 198.03 | 16218 | 45 | 1000 |
| 172.10 | 16211 | 71 | 999 |
| 200.02 | 14157 | 43 | 872 |
| 226.03 | 6493 | 17 | 400 |
| 216.21 | 953 | 27 | 58 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Isoflavan]-A(1OH)-B(1OH) | Isoflavan | Equol |
| 0.000 | [Dihydrochalcone]-A(2OH)-B(none) | Dihydrochalcone | 2',4'-Dihydroxydihydrochalcone |
| 0.000 | [Flavan]-A(1OH)-B(1OH) | Flavan | 7,4'-Dihydroxyflavan |
| 0.000 | [Flavan]-A(2OH)-B(none) | Flavan | 5,7-Dihydroxyflavan |
| 0.000 | [2-Phenylbenzofuran]-A(1OH)-B(2OH) | 2-Phenylbenzofuran | 6,2',4'-Trihydroxy-2-phenylbenzofuran |
| Level: 3, プリカーサーm/z: 359.16824 |
| Splash: splash10-00kf-0089000000-693952ad93a3542f0ea3 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 243.10 | 4093 | 116 | 1000 |
| 316.31 | 3261 | 43 | 796 |
| 341.23 | 1270 | 18 | 310 |
| 315.58 | 768 | 44 | 187 |
| 323.09 | 615 | 36 | 150 |
| 297.17 | 422 | 62 | 103 |
| 280.17 | 391 | 79 | 95 |
| 244.07 | 351 | 115 | 85 |
| 190.08 | 289 | 169 | 70 |
| 172.00 | 245 | 187 | 59 |
| 281.07 | 243 | 78 | 59 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.107 | [Isoflavone]-A(1OH, 1OMe)-B(3OMe) | Isoflavone | 7-Hydroxy-6,2',4',5'-tetramethoxyisoflavone |
| 0.107 | [Isoflavone]-A(1OH, 1OMe)-B(3OMe) | Isoflavone | Robustigenin |
| 0.107 | [Isoflavone]-A(1OH, 2OMe)-B(2OMe) | Isoflavone | Belamcandin |
| 0.100 | [Chalcone]-A(5OMe)-B(none) | Chalcone | Pedicellin |
| 0.063 | [Flavone]-A(1OH, 1OMe)-B(3OMe) | Flavone | Prosogerin D |
| 0.063 | [Flavone]-A(2OMe)-B(1OH, 2OMe) | Flavone | 3'-Hydroxy-7,8,4',5'-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 1OMe)-B(3OMe) | Flavone | Corymbosin |
| 0.063 | [Flavone]-A(1OH, 1OMe)-B(3OMe) | Flavone | Isoetin 7,2',4',5'-tetramethyl ether |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 6-Hydroxyluteolin 5,6,3',4'-tetramethyl ether |
| 0.063 | [Flavone]-A(3OMe)-B(1OH, 1OMe) | Flavone | Ageconyflavone B |
| 0.063 | [Flavone]-A(3OMe)-B(1OH, 1OMe) | Flavone | 6-Hydroxyluteolin 5,6,7,4'-tetramethyl ether |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 6-Hydroxyluteolin 6,7,3',4'-tetramethyl ethe |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 5-Hydroxy-2',3',7,8-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 5-Hydroxy-2',3',7,8-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 5-hydroxy-7,8,2',5'-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | Altisin |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | Hypolaetin 7,8,3',4'-tetramethyl ether |
| 0.063 | [Flavone]-A(1OH, 2OMe)-B(2OMe) | Flavone | 2-(2,4-dimethoxyphenyl)-5-hydroxy-7,8-dimethoxyflavone |
| 0.063 | [Flavone]-A(4OMe)-B(1OH) | Flavone | 4'-Hydroxy-5,6,7,8-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 3OMe)-B(1OMe) | Flavone | 7-Hydroxy-5,6,8,4'-tetramethoxyflavone |
| 0.063 | [Flavone]-A(1OH, 3OMe)-B(1OMe) | Flavone | Gardenin B |
| 0.038 | [Flavonol]-A(2OMe)-B(2OMe) | Flavonol | Quercetin 5,7,3',4'-tetramethyl ether |
| 0.000 | [Aurone]-A(2OH, 1Methyl)-B(3OMe) | Aurone | 4,6-Dihydroxy-5-methyl-3',4',5'-trimethoxyaurone |
| 0.000 | [Aurone]-A(2OH, 1Methyl)-B(3OMe) | Aurone | 4,6-Dihydroxy-7-methyl-3',4',5'-trimethoxyaurone |
| 0.000 | [beta-Hydroxy(or Oxodihydro)chalcone]-A(3OMe)-B(1([@@]-Methylenedioxy)) | beta-Hydroxy(or Oxodihydro)chalcone | Ponganone X |
| 0.000 | [Flavanone]-A(1OH, 1(2,3-Dihydroxy-3-methylbutyl))-B(1OH) | Flavanone | Brosimacutin A |
| 0.000 | [Flavanone]-A(2OMe, 1Methyl)-B(2OMe) | Flavanone | 2',4',5,7-Tetramethoxy-8-methylflavanone |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Flavanone]-A(1OH, 1OMe, 2Methyl)-B(1OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Flavanone | Scaberin |
| 0.000 | [Flavone]-A(2OH, 2Methyl)-B(1OH, 2OMe) | Flavone | 5,7,3'-Trihydroxy-4',5'-dimethoxy-6,8-dimethylflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1([@@]-Methylenedioxy)) | Flavone | Linderoflavone A |
| 0.000 | [UBR-type derivative / [3',6']-Benzoquinonyl-type Flavone]-A(1OH, 1OMe)-B(2OMe) | UBR-type derivative / [3',6']-Benzoquinonyl-type Flavone | 5-Hydroxy-7,2',4'-trimethoxy-3',6'-diketoflavone |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(1OH)-C(1(O-Isobutyroyl)) | Dihydroflavonol | 3,5,7,3'-Tetrahydroxyflavanone 3-O-Isobutyrate |
| 0.000 | [Flavonol (3-OMe)]-A(1OMe)-B(1OH, 2OMe) | Flavonol | 4'-Hydroxy-3,7,3',5'-tetramethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OMe) | Flavonol | Santoflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OMe) | Flavonol | Quercetin 3,5,3',4'-tetramethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe)-B(1OH, 1OMe) | Flavonol | Quercetin 3,5,7,3'-tetramethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe)-B(1OH, 1OMe) | Flavonol | Quercetin 3,5,7,4'-tetramethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OMe) | Flavonol | Retusin(Ariocarpus) |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe, 1Methyl)-B(1OH, 1OMe) | Flavonol | 6-C-Methylquercetin 3,7,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe, 1Methyl)-B(1OH, 1OMe) | Flavonol | 5,4'-Dihydroxy-3,7,3'-trimethoxy-8-methylflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe, 2Methyl)-B(2OH) | Flavonol | 2-(3,4-Dihydroxyphenyl)-5-hydroxy-3,7-dimethoxy-6,8-dimethyl-4H-1-benzopyran-4-one |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(1OH, 1OMe) | Flavonol | 5,7,4'-Trihydroxy-3,3'-dimethoxy-6,8-dimethylflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OMe) | Flavonol | 6-Hydroxykaempferol 3,5,7,4'-tetramethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OMe) | Flavonol | Penduletin 4'-methyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(1OH) | Flavonol | 8-C-Methyl-6-hydroxykaempferol 3,6,7-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH, 1OMe) | Flavonol | 5,4'-Dihydroxy-3,3'-dimethoxy-6,7-methylenedioxyflavone |
| 0.000 | [Flavonol]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH, 1OMe) | Flavonol | 3,3'-Dihydroxy-5,4'-dimethoxy-6,7-methylenedioxyflavone |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy)) | Flavonol | 3,7-Dihydroxy-5,6-dimethoxy-3',4'-methylenedioxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OMe) | Flavonol | 5-Hydroxy-3,7,8,2'-tetramethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OMe) | Flavonol | Flindulatin |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(1OH) | Flavonol | 5-Hydroxy-2-(4-hydroxyphenyl)-3,7,8-trimethoxy-6-methyl-4H-1-benzopyran-4-one |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1([@@]-Methylenedioxy)) | Flavonol | 3,8-Dimethoxy-5,7-dihydroxy-3',4'-methylenedioxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 3OMe)-B(none) | Flavonol | 5-Hydroxy-3,6,7,8-tetramethoxyflavone |
| 0.000 | [CCS-type derivative / [3,2']-Formyloxidoflavone]-A(2OH, 1OMe)-B(2OH) | CCS-type derivative / [3,2']-Formyloxidoflavone | Distemonanthin |
| 0.000 | [Flavan 3-ol]-A(2OH, 1(C-Prenyl))-B(2OH) | Flavan 3-ol | 6-Prenylcatechin |
| 0.000 | [Flavan 3-ol]-A(2OH, 1(C-Prenyl))-B(2OH) | Flavan 3-ol | 8-Prenylcatechin |
| 0.000 | [Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH, 2OMe) | Isoflavone | 5,3'-Dihydroxy-4',5'-dimethoxy-6,7-methylenedioxyisoflavone |
| 0.000 | [Isoflavone]-A(2OH, 1OMe)-B(1OMe, 1([@@]-Methylenedioxy)) | Isoflavone | Dalpalatin |
| 0.000 | [Isoflavanone]-A(1OH, 1(3-hydroxy-3-methylbutyl))-B(2OH) | Isoflavanone | 7,2',4'-Trihydroxy-8-(3-hydroxy-3-methylbutyl)isoflavanone |
| 0.000 | [Rotenone]-A(1OH, 1OMe)-B(2OMe) | Rotenone | Sermundone |
| 0.000 | [12a-Hydroxyrotenone]-A(1OMe)-B(2OMe) | 12a-Hydroxyrotenone | 12a-Hydroxymunduserone |
| 0.000 | [4-phenylcoumarin]-A(1OH, 2OMe)-B(2OMe) | 4-phenylcoumarin | 8-Hydroxy-5,7,3',4'-tetramethoxy-4-phenylcoumarin |
| 0.000 | [4-phenylcoumarin]-A(3OMe)-B(1OH, 1OMe) | 4-phenylcoumarin | 3'-Hydroxy-5,7,8,4'-tetramethoxy-4-phenylcoumarin |