ピーク情報
|
トマト Micro-Tom 成熟果実の果皮
pos
|
| Peak #3174 MN MID: SE203_S11_M90 |
| m/z: 757.21582, RT: 36.00, 強度: 359490, ログ強度: 1.99, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 6 |
| DB検索結果: (79 names) Orientin 4'-O-glucoside-2''-O-rhamnoside;Pelargonidin 3-gentiotrioside;Isovitexin 7,2''-di-O-glucoside;Cyanidin 3-O-beta-rutinoside-7-O-beta-glucoside;Marginatoside;Isoorientin 3'-O-neohesperidoside;K... |
| DBごとのヒット数: ALL 64 KG 1 KN 59 HM 4 |
| 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 |
|---|---|---|---|---|
| C33H40O20 | 756.21129 | -3.636 | Orientin 4'-O-glucoside-2''-O-rhamnoside | FlavonoidViewer: FL3FACDS0010 KNApSAcK: C00006312 LipidMAPS: LMPK12110543 |
| C33H40O20 | 756.21129 | -3.636 | Pelargonidin 3-gentiotrioside | FlavonoidViewer: [1]FL7AAAGL0008 KNApSAcK: [1]C00006642 LipidMAPS: [1]LMPK12010022 |
| C33H40O20 | 756.21129 | -3.636 | Isovitexin 7,2''-di-O-glucoside | FlavonoidViewer: FL3FAADS0016, FL3FAADS0017, FL3FAADS0032 KNApSAcK: C00006321, C00006322, C00014032 LipidMAPS: LMPK12110301, LMPK12110302, LMPK12110317 |
| C33H40O20 | 756.21129 | -3.636 | Marginatoside | FlavonoidViewer: FL3FAACS0037 KNApSAcK: C00006318 LipidMAPS: LMPK12110230 |
| C33H40O20 | 756.21129 | -3.636 | Cyanidin 3-O-beta-rutinoside-7-O-beta-glucoside | FlavonoidViewer: [1]FL7AACGL0092 KNApSAcK: [1]C00011068 LipidMAPS: [1]LMPK12010201 |
| C33H40O20 | 756.21129 | -3.636 | Isoorientin 3'-O-neohesperidoside | FlavonoidViewer: FL3FACDS0014 KNApSAcK: C00006316 LipidMAPS: LMPK12110547 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-gentiobioside-7-rhamnoside | FlavonoidViewer: FL5FAAGL0040 HMDB: HMDB0034396, HMDB0302884 KNApSAcK: C00005234 LipidMAPS: LMPK12111762 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-neohesperidoside-7-glucoside | FlavonoidViewer: FL5FAAGA0021, FL5FAAGL0042 KNApSAcK: C00005223, C00005236 LipidMAPS: LMPK12111682, LMPK12111764 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-neohesperidoside-4'-glucoside | FlavonoidViewer: FL5FAAGS0094 KNApSAcK: C00013761 LipidMAPS: LMPK12111929 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-isorhamninoside | FlavonoidViewer: FL5FACGA0017, FL5FACGL0024 KNApSAcK: C00005441, C00005450 LipidMAPS: LMPK12112057, LMPK12112109 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rutinoside-7-glucoside | FlavonoidViewer: FL5FAAGA0023, FL5FAAGL0044, FL5FAAGL0045 HMDB: HMDB0040543, HMDB0302714 KNApSAcK: C00005225, C00005238, C00005239 LipidMAPS: LMPK12111684, LMPK12111766, LMPK12111767 |
| C33H40O20 | 756.21129 | -3.636 | Cyanidin 3-rutinoside-5-glucoside | FlavonoidViewer: [1]FL7AACGL0019 KEGG: [1]C12646, [1f]C04787 KNApSAcK: [1]C00006675 LipidMAPS: [1]LMPK12010128 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-(3Rha-glucosylrutinoside) | FlavonoidViewer: FL5FAAGA0013, FL5FAAGL0023 HMDB: HMDB0038768, HMDB0301689, HMDB0303686 KNApSAcK: C00005201, C00005210 LipidMAPS: LMPK12111674, LMPK12111746 |
| C33H40O20 | 756.21129 | -3.636 | Luteolin 7-glucoside-4'-neohesperidoside | FlavonoidViewer: FL3FACGS0046 KNApSAcK: C00004306 LipidMAPS: LMPK12110681 |
| C33H40O20 | 756.21129 | -3.636 | Petunidin 3-[6-(rhamnosyl)-2-(xylosyl)glucoside] | FlavonoidViewer: [1]FL7AAHGL0024 KNApSAcK: [1]C00014863 LipidMAPS: [1]LMPK12010371 |
| C33H40O20 | 756.21129 | -3.636 | Peonidin 3-sambubioside 5-glucoside | HMDB: [1]HMDB0041765 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-rhamnosyl-(1->4)-rhamnoside-7-galactoside | FlavonoidViewer: FL5FACGS0080 KNApSAcK: C00013852 LipidMAPS: LMPK12112245 |
| C33H40O20 | 756.21129 | -3.636 | Retamatrioside | FlavonoidViewer: FL5FCDGS0004 KNApSAcK: C00013936 LipidMAPS: LMPK12112640 |
| C33H40O20 | 756.21129 | -3.636 | Rhamnocitrin 3-apiosyl-(1->2)-glucoside-4'-glucoside | FlavonoidViewer: FL5FCAGL0006 KNApSAcK: C00005284 LipidMAPS: LMPK12112567 |
| C33H40O20 | 756.21129 | -3.636 | Cyanidin 3-rutinoside-3'-glucoside | FlavonoidViewer: [1]FL7AACGL0020 KNApSAcK: [1]C00006676 LipidMAPS: [1]LMPK12010129 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-glucosyl-(1->2)-rhamnoside-7-rhamnoside | FlavonoidViewer: FL5FACGS0043 KNApSAcK: C00005475 LipidMAPS: LMPK12112208 |
| C33H40O20 | 756.21129 | -3.636 | 5,7,4'-Trihydroxyisoflavone 7-O-beta-D-glucopyranoside-4'-O-[(beta-D-gucopyranosyl)-(1->2)-beta-D-glucopyranoside] | KNApSAcK: C00019137 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-O-rhamninoside | FlavonoidViewer: FL5FACGA0016 KNApSAcK: C00005440, C00040132 LipidMAPS: LMPK12112056 |
| C33H40O20 | 756.21129 | -3.636 | Vincanin A | FlavonoidViewer: [1]FL7AAGGA0005 KNApSAcK: [1]C00006714 LipidMAPS: [1]LMPK12010264 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rhamnosyl-(1->6)-glucosyl-(1->6)-galactoside | FlavonoidViewer: FL5FAAGS0081 HMDB: HMDB0302425 KNApSAcK: C00013748 LipidMAPS: LMPK12111916 |
| C33H40O20 | 756.21129 | -3.636 | Camelliaside A | FlavonoidViewer: FL5FAAGA0017, FL5FAAGL0029, FL5FAAGL0030 HMDB: HMDB0039951, HMDB0302644 KNApSAcK: C00005205, C00005216, C00005217 LipidMAPS: LMPK12111678, LMPK12111752, LMPK12111753 |
| C33H40O20 | 756.21129 | -3.636 | Cyanidin 3-(2G-glucosylrutinoside) | FlavonoidViewer: [1]FL7AACGL0016 HMDB: [1]HMDB0037988 KNApSAcK: [1]C00006672 LipidMAPS: [1]LMPK12010125 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->2)-[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside] | HMDB: HMDB0038253 |
| C33H40O20 | 756.21129 | -3.636 | Isovitexin 4',2''-di-O-glucoside | FlavonoidViewer: FL3FAADS0030 KNApSAcK: C00006407 LipidMAPS: LMPK12110315 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-xylosyl-(1->2)-glucoside-7-rhamnoside | FlavonoidViewer: FL5FADGS0025 KNApSAcK: C00013917 LipidMAPS: LMPK12112382 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-glucosyl-(1->4)-rhamnosyl-(1->2)-glucoside | FlavonoidViewer: FL5FAAGS0082 KNApSAcK: C00013749 LipidMAPS: LMPK12111917 |
| C33H40O20 | 756.21129 | -3.636 | Saponarin 4'-O-glucoside | HMDB: HMDB0035004 KNApSAcK: C00037790 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rhamnosyl-(1->2)-[glucosyl-(1->4)-glucoside] | FlavonoidViewer: FL5FAAGS0084 KNApSAcK: C00013751 LipidMAPS: LMPK12111919 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-O-[6''-O-rhamnosyl)glucoside] 7-O-rhamnoside | FlavonoidViewer: FL5FACGL0039, FL5FACGS0060 KNApSAcK: C00005470, C00007402 LipidMAPS: LMPK12112124 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-(3G-glucosylneohesperidoside) | FlavonoidViewer: FL5FAAGL0026 KNApSAcK: C00005213 LipidMAPS: LMPK12111749 |
| C33H40O20 | 756.21129 | -3.636 | Asparagus officinalis Anthocyanin A1 | KNApSAcK: [1]C00054529 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rhamnoside-7,4'-digalactoside | FlavonoidViewer: FL5FAAGS0096 KNApSAcK: C00013763 LipidMAPS: LMPK12111931 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rhamnosyl-(1->2)-glucosyl-(1->6)-galactoside | FlavonoidViewer: FL5FAAGS0080 KNApSAcK: C00013747 LipidMAPS: LMPK12111915 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-rutinoside-4'-glucoside | FlavonoidViewer: FL5FAAGL0050 HMDB: HMDB0303609 KNApSAcK: C00005247 LipidMAPS: LMPK12111772 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-sophoroside-7-rhamnoside | FlavonoidViewer: FL5FAAGL0036 HMDB: HMDB0037427 KNApSAcK: C00005230 LipidMAPS: LMPK12111758 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-rhamnosyl-(1->2)-rhamnosyl-(1->6)-glucoside | FlavonoidViewer: FL5FACGL0023 HMDB: HMDB0040294, HMDB0301700 KNApSAcK: C00005449 LipidMAPS: LMPK12112108 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-apiosyl-(1->6)-glucoside-7-rhamnoside | FlavonoidViewer: FL5FADGL0023 KNApSAcK: C00005578 LipidMAPS: LMPK12112351 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-(2G-apiosylrutinoside) | FlavonoidViewer: FL5FADGL0020 HMDB: HMDB0041470 KNApSAcK: C00005571 LipidMAPS: LMPK12112348 |
| C33H40O20 | 756.21129 | -3.636 | Cyanidin 3-glucosyl-rutinoside | HMDB: [1]HMDB0302725 |
| C33H40O20 | 756.21129 | -3.636 | Vicenin-2,6''-O-glucoside | FlavonoidViewer: FL3FAACS0062 KNApSAcK: C00006408 LipidMAPS: LMPK12110255 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-glucosyl-(1->2)-rhamnoside-7-glucoside | FlavonoidViewer: FL5FAAGS0093 KNApSAcK: C00013760 LipidMAPS: LMPK12111928 |
| C33H40O20 | 756.21129 | -3.636 | Manghaslin | FlavonoidViewer: FL5FACGA0020, FL5FACGL0030 HMDB: HMDB0037959, HMDB0302955 KNApSAcK: C00005444, C00005456 LipidMAPS: LMPK12112060, LMPK12112115 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-glucosyl-(1->2)-[glucosyl-(1->3)-rhamnoside] | FlavonoidViewer: FL5FAAGS0085 KNApSAcK: C00013752 LipidMAPS: LMPK12111920 |
| C33H40O20 | 756.21129 | -3.636 | Luteolin 7-rutinoside-3'-glucoside | FlavonoidViewer: FL3FACGS0043 KNApSAcK: C00004303 LipidMAPS: LMPK12110678 |
| C33H40O20 | 756.21129 | -3.636 | Pelargonidin 3-sophoroside-7-glucoside | FlavonoidViewer: [1]FL7AAAGL0014 HMDB: [1]HMDB0303792 KNApSAcK: [1]C00006649 LipidMAPS: [1]LMPK12010028 |
| C33H40O20 | 756.21129 | -3.636 | Luteolin 7-neohesperidoside-4'-glucoside | FlavonoidViewer: FL3FACGS0045 KNApSAcK: C00004305 LipidMAPS: LMPK12110680 |
| C33H40O20 | 756.21129 | -3.636 | Rubrobrassicin | FlavonoidViewer: [1]FL7AAAGL0012 HMDB: [1]HMDB0033687 KNApSAcK: [1]C00006647 LipidMAPS: [1]LMPK12010026 |
| C33H40O20 | 756.21129 | -3.636 | Quercetin 3-rutinoside-7-rhamnoside | FlavonoidViewer: FL5FACGA0023, FL5FACGL0042 HMDB: HMDB0037353, HMDB0302850 KNApSAcK: C00005461, C00005473 LipidMAPS: LMPK12112063, LMPK12112127 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-xylosylrhamnosyl-(1->6)-galactoside | FlavonoidViewer: FL5FADGA0011 KNApSAcK: C00005565 LipidMAPS: LMPK12112325 |
| C33H40O20 | 756.21129 | -3.636 | Apigenin 7-sophorotrioside | FlavonoidViewer: FL3FAAGS0059 KNApSAcK: C00013609 LipidMAPS: LMPK12110393 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-laminaribioside-7-rhamnoside | FlavonoidViewer: FL5FAAGL0038 KNApSAcK: C00005232 LipidMAPS: LMPK12111760 |
| C33H40O20 | 756.21129 | -3.636 | Apigenin 7-cellobioside-4'-glucoside | FlavonoidViewer: FL3FAAGS0061 KNApSAcK: C00013611 LipidMAPS: LMPK12110395 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-(2G-rhamnosylgentiobioside) | FlavonoidViewer: FL5FAAGL0031 HMDB: HMDB0303608 KNApSAcK: C00005218 LipidMAPS: LMPK12111754 |
| C33H40O20 | 756.21129 | -3.636 | Wyomin | FlavonoidViewer: FL3FACDS0013 HMDB: HMDB0037566 KNApSAcK: C00006315 LipidMAPS: LMPK12110546 |
| C33H40O20 | 756.21129 | -3.636 | Isorhamnetin 3-xylosyl-(1->3)-rhamnosyl-(1->6)-glucoside | FlavonoidViewer: FL5FADGS0023 KNApSAcK: C00013915 LipidMAPS: LMPK12112380 |
| C33H40O20 | 756.21129 | -3.636 | Lucenin-2,7-O-rhamnoside | FlavonoidViewer: FL3FACDS0023 HMDB: HMDB0037411 KNApSAcK: C00006410 LipidMAPS: LMPK12110631 |
| C33H40O20 | 756.21129 | -3.636 | Luteolin 7-rutinoside-4'-glucoside | FlavonoidViewer: FL3FACGS0044 HMDB: HMDB0038470 KNApSAcK: C00004304 LipidMAPS: LMPK12110679 |
| C33H40O20 | 756.21129 | -3.636 | Polygonatiin | FlavonoidViewer: FL3FAACS0061 KNApSAcK: C00006405 LipidMAPS: LMPK12110254 |
| C33H40O20 | 756.21129 | -3.636 | Kaempferol 3-sophoroside-rhamnoside | HMDB: HMDB0302973 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 757.21442 |
| Splash: splash10-0002-0040945000-159984441c820f26a1c3 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 449.15 | 44904 | 308 | 1000 |
| 611.02 | 30205 | 146 | 672 |
| 595.07 | 22929 | 162 | 510 |
| 287.12 | 21738 | 470 | 484 |
| 433.23 | 3636 | 324 | 80 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 449.09796 |
| Splash: splash10-000i-0090000000-cee9de4aaa84e439f3e3 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 287.13 | 42581 | 162 | 1000 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavone]-A(4OMe)-B(1OH, 3OMe) | Flavone | Agehoustin C |
| 0.000 | [Chalcone]-A(4OMe)-B(4OMe) | Chalcone | 2,3,4,5,2',3',4',6'-Octamethoxychalcone |
| 0.000 | [Anthocyanidin]-A(2OH, 1(C-Glu))-B(2OH) | Anthocyanidin | 8-C-Glucosylcyanidin |
| 0.000 | [Flavone]-A(2OH, 1(C-Glu))-B(2OH) | Flavone | Isoorientin |
| 0.000 | [Flavone]-A(2OH, 1(C-Glu))-B(2OH) | Flavone | Orientin |
| 0.000 | [Flavonol]-A(1OH, 1(C-Glu))-B(2OH) | Flavonol | Fisetin 8-C-glucoside |
| 0.000 | [Flavonol]-A(2OH, 1(C-Glu))-B(1OH) | Flavonol | 6-C-Glucopyranosylkaempferol |
| 0.000 | [Flavonol]-A(2OH, 1(C-Glu))-B(1OH) | Flavonol | 8-C-beta-D-Glucopyranosylkaempferol |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Glu))-B(2OH) | Isoflavone | 6-C-Glucosylorobol |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Glu))-B(2OH) | Isoflavone | 8-C-Glucosylorobol |
| 0.000 | [Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH) | Flavone | 6-C-Galactosylluteolin |
| 0.000 | [Flavone]-A(2OH, 1(C-Galactosyl))-B(2OH) | Flavone | 8-C-Galactosylluteolin |
| 0.000 | [Flavone]-A(3OH, 1(C-Galactosyl))-B(1OH) | Flavone | 6-C-Galactosylisoscutellarein |
| 0.000 | [CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe) | CCS-type derivative / [2',3]-Prenyloxidoflavone | Cycloartomunin |
| 0.000 | [CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1OMe) | CCS-type derivative / [2',3]-Isopropenylethanoflavone | Artomunoxanthone |
| 0.000 | [CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(1OH, 1OMe)-B(2OH, 1([2,3:@@]-(6,6-Dimethylpyrano))) | CCS-type derivative / [2',3]-Isopropenylethanoflavone | Artonol E |
| 0.000 | [CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe) | CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone | Cycloartomunoxanthone |
| 0.000 | [UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH) | UBR-type derivative / 3',6'-Oxo-4'-enyl-[1',2']-epoxy-type [2',3]-Isopropenylethanoflavone | Artonin P |
| 0.000 | [Flavonol (3-OMe)]-A(4OMe)-B(1OH, 2OMe) | Flavonol | 3'-Hydroxy-3,5,6,7,8,4',5'-heptamethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 3OMe)-B(3OMe) | Flavonol | 5-Hydroxy-3,6,7,8,3',4',5'-heptamethoxyflavone |
| 0.000 | [4-Hydroxy-3-phenylcoumarin]-A(1OMe, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe) | 4-Hydroxy-3-phenylcoumarin | Lonchocarpenin |
| Level: 3, プリカーサーm/z: 611.02594 |
| Splash: splash10-0002-0020900000-98f9c60d562b434b1cbd |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 449.20 | 5826 | 162 | 1000 |
| 287.16 | 1900 | 324 | 326 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Flavone]-A(2OH, 2(C-Glu))-B(2OH) | Flavone | Lucenin 2 |
| 0.000 | [Isoflavone]-A(2OH, 2(C-Glu))-B(2OH) | Isoflavone | Orobol 6,8-di-C-glucoside |
| 0.000 | [Flavone]-A(2OH, 1(1(O-(E)-Caffeoyl)-C-Glu))-B(2OH) | Flavone | Isoorientin 2''-O-(E)-caffeate |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Caffeoyl)-C-Glu))-B(2OH) | Flavone | Isoorientin 6''-O-caffeate |
| 0.000 | [Flavone]-A(2OH, 1((O-Caffeoyl)-C-Glu))-B(2OH) | Flavone | Isoorientin 2''-O-caffeate |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Caffeoyl)-C-Glu))-B(2OH) | Flavone | Orientin 2''-O-caffeate |