ピーク情報
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パセリ 葉
pos
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| Peak #3097 MN MID: SE61_S21_M90 |
| m/z: 627.15304, RT: 28.76, 強度: 21183, ログ強度: 0.74, 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: (40 names) Myricetin 3-neohesperidoside;Quercetin 3,5-diglucoside;6-Hydroxykaempferol 3,6-diglucoside;Herbacetin 3,8-diglucoside;6,8-Dihydroxykaempferol 3-rutinoside;Hypoletin 8-gentiobioside;Delphinidin 3-genti... |
| DBごとのヒット数: ALL 36 KG 4 KN 29 HM 3 |
| 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 |
|---|---|---|---|---|
| C27H30O17 | 626.14830 | -4.055 | Myricetin 3-neohesperidoside | FlavonoidViewer: FL5FAGGS0023 HMDB: HMDB0038287 KNApSAcK: C00013965 LipidMAPS: LMPK12112455 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3,5-digalactoside | FlavonoidViewer: FL5FACGA0011 HMDB: HMDB0302543 KNApSAcK: C00005419 LipidMAPS: LMPK12112051 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxykaempferol 3,6-diglucoside | FlavonoidViewer: FL5FEAGL0002 KNApSAcK: C00005308 LipidMAPS: LMPK12112818 |
| C27H30O17 | 626.14830 | -4.055 | Herbacetin 3,8-diglucoside | HMDB: HMDB0040371 |
| C27H30O17 | 626.14830 | -4.055 | 6,8-Dihydroxykaempferol 3-rutinoside | FlavonoidViewer: FL5FGAGL0001 KNApSAcK: C00005629 LipidMAPS: LMPK12113300 |
| C27H30O17 | 626.14830 | -4.055 | 8-Hydroxyluteolin 8-gentiobioside | FlavonoidViewer: FL3FFCGS0006 HMDB: HMDB0038824 KNApSAcK: C00004422 LipidMAPS: LMPK12111375 |
| C27H30O17 | 626.14830 | -4.055 | Delphinidin 3-gentiobioside | FlavonoidViewer: [1]FL7AAGGL0038 HMDB: [1]HMDB0038006, [1]HMDB0041594 KNApSAcK: [1]C00013564 LipidMAPS: [1]LMPK12010314 |
| C27H30O17 | 626.14830 | -4.055 | Vicenin | HMDB: HMDB0039878, HMDB0302244 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3-gentiobioside | FlavonoidViewer: FL5FACGA0008, FL5FACGL0008, FL5FACGL0011 HMDB: HMDB0301692, HMDB0302574, HMDB0303590 KNApSAcK: C00005399, C00005408, C00005411 LipidMAPS: LMPK12112048, LMPK12112093, LMPK12112096 |
| C27H30O17 | 626.14830 | -4.055 | Delphinidin 3-sophoroside | FlavonoidViewer: [1]FL7AAGGL0004 HMDB: [1]HMDB0038007 KEGG: [1]C16307 KNApSAcK: [1]C00006705 LipidMAPS: [1]LMPK12010280 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3,4'-diglucoside | FlavonoidViewer: FL5FACGL0019 HMDB: HMDB0037363, HMDB0304730 KNApSAcK: C00005436 LipidMAPS: LMPK12112104 |
| C27H30O17 | 626.14830 | -4.055 | Sinocrassoside D2 | KNApSAcK: C00032139 |
| C27H30O17 | 626.14830 | -4.055 | 8-Hydroxyluteolin 7-allosyl-(1->2)-glucoside | FlavonoidViewer: FL3FFCGS0005, FL3FFCGS0018 KNApSAcK: C00004421, C00004518 LipidMAPS: LMPK12111374, LMPK12111387 |
| C27H30O17 | 626.14830 | -4.055 | 6,8-Di-C-glucopyranosyltricetin | FlavonoidViewer: FL3FAGCS0005 KNApSAcK: C00006241 LipidMAPS: LMPK12110836 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 7,4'-diglucoside | FlavonoidViewer: FL5FACGS0039 HMDB: HMDB0037356, HMDB0304757 KNApSAcK: C00005438 LipidMAPS: LMPK12112204 |
| C27H30O17 | 626.14830 | -4.055 | Gossypetin 7-glucosyl-(1->3)-rhamnoside | FlavonoidViewer: FL5FFCGS0008 KNApSAcK: C00005695 LipidMAPS: LMPK12113201 |
| C27H30O17 | 626.14830 | -4.055 | Tricetin 3',5'-diglucoside | FlavonoidViewer: FL3FAGGS0005 KNApSAcK: C00004456 LipidMAPS: LMPK12110843 |
| C27H30O17 | 626.14830 | -4.055 | Delphinidin 3,5-diglucoside | FlavonoidViewer: [1]FL7AAGGL0007 HMDB: [1]HMDB0030693 KEGG: [1]C16312 KNApSAcK: [1]C00006709, [1]C00037021 LipidMAPS: [1]LMPK12010283 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3-laminaribioside | FlavonoidViewer: FL5FACGL0010, FL5FACGS0070 HMDB: HMDB0041358 KNApSAcK: C00005410, C00013842 LipidMAPS: LMPK12112095, LMPK12112235 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxyluteolin 7-O-laminaribioside | KNApSAcK: C00042162 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxyluteolin 7-gentiobioside | FlavonoidViewer: FL3FECGS0018 KNApSAcK: C00004393 LipidMAPS: LMPK12111191 |
| C27H30O17 | 626.14830 | -4.055 | Gossypetin 7-rhamnoside-8-glucoside | FlavonoidViewer: FL5FFCGS0009 KNApSAcK: C00005696 LipidMAPS: LMPK12113202 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxydelphinidin 3-rutinoside | FlavonoidViewer: [1]FL7AEGGL0001 KNApSAcK: [1]C00006752 LipidMAPS: [1]LMPK12010429 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxyluteolin 7-sophoroside | FlavonoidViewer: FL3FECGS0017 KNApSAcK: C00004392 LipidMAPS: LMPK12111190 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3,7-diglucoside | FlavonoidViewer: FL5FACGA0013, FL5FACGL0015 HMDB: HMDB0303592 KNApSAcK: C00005424, C00005427, C00037713 LipidMAPS: LMPK12112053, LMPK12112100 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3,3'-diglucoside | FlavonoidViewer: FL5FACGL0018 HMDB: HMDB0303591 KNApSAcK: C00005435 LipidMAPS: LMPK12112103 |
| C27H30O17 | 626.14830 | -4.055 | Myricetin 3-rhamnoside-3'-glucoside | FlavonoidViewer: FL5FAGGS0024 KNApSAcK: C00013966 LipidMAPS: LMPK12112456 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3-glucosyl-(1->4)-mannoside | FlavonoidViewer: FL5FACGA0005, FL5FACGA0007, FL5FACGS0025 KNApSAcK: C00005396, C00005398, C00005414 LipidMAPS: LMPK12112045, LMPK12112047, LMPK12112190 |
| C27H30O17 | 626.14830 | -4.055 | Quercetin 3-glucosyl-(1->2)-galactoside | FlavonoidViewer: FL5FACGA0006, FL5FACGL0007, FL5FACGL0009 HMDB: HMDB0037537 KEGG: C12667 KNApSAcK: C00005397, C00005407, C00005409 LipidMAPS: LMPK12112046, LMPK12112092, LMPK12112094 |
| C27H30O17 | 626.14830 | -4.055 | Gossypetin 3-rutinoside | FlavonoidViewer: FL5FFCGL0002 KNApSAcK: C00005692 LipidMAPS: LMPK12113181 |
| C27H30O17 | 626.14830 | -4.055 | Myricetin 3-rhamnoside-7-glucoside | FlavonoidViewer: FL5FAGGS0010 KNApSAcK: C00005741 LipidMAPS: LMPK12112442 |
| C27H30O17 | 626.14830 | -4.055 | Herbacetin 8-gentiobioside | FlavonoidViewer: FL5FFAGS0013 KNApSAcK: C00005349 LipidMAPS: LMPK12113127 |
| C27H30O17 | 626.14830 | -4.055 | 6-Hydroxykaempferol 6,7-diglucoside | HMDB: HMDB0039924 |
| C27H30O17 | 626.14830 | -4.055 | Delphinidin 3,7-diglucoside | FlavonoidViewer: [1]FL7AAGGL0008 KEGG: [1]C20496 KNApSAcK: [1]C00006711 LipidMAPS: [1]LMPK12010284 |
| C27H30O17 | 626.14830 | -4.055 | Myricetin-3-O-rutinoside | FlavonoidViewer: FL5FAGGA0002, FL5FAGGL0003 HMDB: HMDB0040861 KNApSAcK: C00005735, C00005737 LipidMAPS: LMPK12112413, LMPK12112422 |
| C27H30O17 | 626.14830 | -4.055 | Myricetin 3-galactoside-3'-rhamnoside | FlavonoidViewer: FL5FAGGA0004 KNApSAcK: C00005744 LipidMAPS: LMPK12112415 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 627.15234 |
| Splash: splash10-000i-0000190000-f783308b68a542d92245 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 539.13 | 736 | 88 | 1000 |
| 497.08 | 99 | 130 | 133 |
| 349.15 | 81 | 278 | 109 |
| 583.15 | 74 | 44 | 100 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavone]-A(2OH, 2(C-Glu))-B(3OH) | Flavone | 6,8-Di-C-glucopyranosyltricetin |
| 0.000 | [Flavone]-A(2OH, 1((O-<2,4,5-Trihydroxycinnamoyl>)-C-Glu))-B(2OH) | Flavone | Isoorientin 2''-(2,4,5-dihydroxycinnamante) |
| Level: 3, プリカーサーm/z: 539.12671 |
| Splash: splash10-0002-0007900000-f56213af610dd626782b |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 497.18 | 315 | 42 | 1000 |
| 349.13 | 222 | 190 | 705 |
| 289.09 | 38 | 250 | 121 |
| 331.31 | 35 | 208 | 109 |
| 307.17 | 26 | 232 | 81 |
| 335.35 | 18 | 204 | 56 |
| 455.29 | 18 | 84 | 56 |
| 433.03 | 17 | 106 | 54 |
| 374.84 | 17 | 164 | 53 |
| 427.12 | 16 | 112 | 51 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Dihydroflavonol]-A(2OH, 1(C-Prenyl), 1Geranyl)-B(2OH, 1OMe) | Dihydroflavonol | Kenusanone C |
| 0.000 | [Flavan]-A(1OH, 1OMe, 1(1(O-Benzoyl)-2,4,6-Trihydroxy-3-methylstyryl))-B(none) | Flavan | 8-trans-[2-(6-Benzoyloxy-4-hydroxy-2-methoxy-3-methylphenyl)ethenyl]-5-methoxyflavan-7-ol |