ピーク情報
|
はつか大根 葉
pos
|
| Peak #2458 MN MID: SE202_S21_M90 |
| m/z: 273.07567, RT: 28.58, 強度: 2185, ログ強度: -0.12, 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: (66 names) Alternariol monomethyl ether;3,4'-Dihydroxy-5-methoxy-6'-methyldibenzo[a]pyrone;TMC-256A1;3,4,9-Trihydroxypterocarpan;1,6-Dihydroxy-3-methoxy-8-methylxanthone;Griseoxanthone C;5,7,3'-Trihydroxyflavano... |
| DBごとのヒット数: ALL 63 KG 15 KN 41 HM 7 |
| FlavonoidSearch最大スコア MS2: 0.294, 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 |
|---|---|---|---|---|
| C15H12O5 | 272.06847 | -0.281 | 4-Hydroxydemethylmedicarpin | FlavonoidViewer: FLID3ANS0002 HMDB: HMDB0034002 KNApSAcK: C00009612 LipidMAPS: LMPK12070073 |
| C15H12O5 | 272.06847 | -0.281 | 5,7,3'-Trihydroxyflavanone | FlavonoidViewer: FL2FA9NS0007 KNApSAcK: C00008479 LipidMAPS: LMPK12140220 |
| C15H12O5 | 272.06847 | -0.281 | 2beta-5,7-Trihydroxyflavanone | FlavonoidViewer: FL2FA9NS0006 KNApSAcK: C00008407 LipidMAPS: LMPK12140219 |
| C15H12O5 | 272.06847 | -0.281 | 2'-Hydroxydihydrodaidzein | FlavonoidViewer: FLIB1LNS0003 HMDB: HMDB0033928 KEGG: C03567 KNApSAcK: C00009535 LipidMAPS: LMPK12050463 |
| C15H12O5 | 272.06847 | -0.281 | Licodione | FlavonoidViewer: FL1CHYNS0002 KEGG: C01592 KNApSAcK: C00006994 LipidMAPS: LMPK12120396 |
| C15H12O5 | 272.06847 | -0.281 | 5,8,4'-Trihydroxyflavanone | FlavonoidViewer: FL2F9ANS0002 HMDB: HMDB0031824 KNApSAcK: C00008392 LipidMAPS: LMPK12140104 |
| C15H12O5 | 272.06847 | -0.281 | Naringenin chalcone | FlavonoidViewer: FL1CAANS0001 HMDB: HMDB0029631 KEGG: C06561 KNApSAcK: C00007233, C00052701 LipidMAPS: LMPK12120264 |
| C15H12O5 | 272.06847 | -0.281 | (-)-Glycinol | FlavonoidViewer: FLIDHXNS0003 HMDB: HMDB0034105 KEGG: C01263 KNApSAcK: C00002532 LipidMAPS: LMPK12070128 |
| C15H12O5 | 272.06847 | -0.281 | Butein | FlavonoidViewer: FL1C1CNS0001 KEGG: C08578 KNApSAcK: C00006941 LipidMAPS: LMPK12120111 |
| C15H12O5 | 272.06847 | -0.281 | 5,7,2'-Trihydroxyflavanone | FlavonoidViewer: FL2FA8NS0005 KNApSAcK: C00008478 LipidMAPS: LMPK12140125 |
| C15H12O5 | 272.06847 | -0.281 | Naringenin | FlavonoidViewer: FL2FAANS0001 HMDB: HMDB0002670, HMDB0242579 KEGG: C00509 KNApSAcK: C00000982, C00029518, C00048239 LipidMAPS: LMPK12140001 |
| C15H12O5 | 272.06847 | -0.281 | Butin | FlavonoidViewer: FL2F1CNS0001 HMDB: HMDB0249463 KEGG: C09614 KNApSAcK: C00000945 LipidMAPS: LMPK12140075 |
| C15H12O5 | 272.06847 | -0.281 | Dihydronorwogonin | FlavonoidViewer: FL2FF9NS0001 KNApSAcK: C00008151 LipidMAPS: LMPK12140657 |
| C15H12O5 | 272.06847 | -0.281 | Dihydrobaicalein | FlavonoidViewer: FL2FE9NS0001 KNApSAcK: C00008146 LipidMAPS: LMPK12140610 |
| C15H12O5 | 272.06847 | -0.281 | Pseudosindorin | FlavonoidViewer: FL1C19NS0003 KNApSAcK: C00006947 LipidMAPS: LMPK12120018 |
| C15H12O5 | 272.06847 | -0.281 | 2,4,2',4'-Tetrahydroxychalcone | FlavonoidViewer: FL1C1LNS0001 KNApSAcK: C00006940 LipidMAPS: LMPK12120128 |
| C15H12O5 | 272.06847 | -0.281 | Pinobanksin | FlavonoidViewer: FL4DA9NS0001 HMDB: [-1]HMDB0303968 KEGG: C09826 KNApSAcK: C00000991 |
| C15H12O5 | 272.06847 | -0.281 | 7,8,4'-Trihydroxyflavanone | FlavonoidViewer: FL2F3ANS0001 KNApSAcK: C00008192 LipidMAPS: LMPK12140091 |
| C15H12O5 | 272.06847 | -0.281 | Garbanzol | FlavonoidViewer: FL4D1ANS0001 HMDB: HMDB0037254, HMDB0303585 KEGG: C09751 KNApSAcK: C00000964 |
| C15H12O5 | 272.06847 | -0.281 | 4,2',3',4'-Tetrahydroxychalcone | FlavonoidViewer: FL1C3ANS0001 KNApSAcK: C00006948 LipidMAPS: LMPK12120151 |
| C15H12O5 | 272.06847 | -0.281 | Alternariol monomethyl ether | KNApSAcK: C00023662 |
| C15H12O5 | 272.06847 | -0.281 | TMC-256A1 | KNApSAcK: C00015079 |
| C15H12O5 | 272.06847 | -0.281 | 1,6-Dihydroxy-3-methoxy-8-methylxanthone | KNApSAcK: C00029363 |
| C15H12O5 | 272.06847 | -0.281 | Hibiscoquinone D | KNApSAcK: C00020104 |
| C15H12O5 | 272.06847 | -0.281 | Securixanthone B | KNApSAcK: C00037806 |
| C15H12O5 | 272.06847 | -0.281 | Bhimamycin A | KNApSAcK: C00015008 |
| C15H12O5 | 272.06847 | -0.281 | 2-Hydroxy-1,7-dimethoxyxanthone | KNApSAcK: C00036490 |
| C15H12O5 | 272.06847 | -0.281 | TUCARESOL | HMDB: HMDB0259322 |
| C15H12O5 | 272.06847 | -0.281 | 5-Hydroxy-1,3-dimethoxyxanthone | KNApSAcK: C00029565 |
| C15H12O5 | 272.06847 | -0.281 | 7,3',5'-Trihydroxyflavanone | KNApSAcK: C00052759 |
| C15H12O5 | 272.06847 | -0.281 | 2,7,4'-Trihydroxyisoflavanone | HMDB: HMDB0304047 KEGG: C15567 |
| C15H12O5 | 272.06847 | -0.281 | 1-Hydroxy-3,7-dimethoxyxanthone | HMDB: HMDB0030873 |
| C15H12O5 | 272.06847 | -0.281 | 3-Hydroxy-1,5-dimethoxyxanthone | KNApSAcK: C00052680 |
| C15H12O5 | 272.06847 | -0.281 | 8-Hydroxydihydrodaidzein | HMDB: HMDB0041704 |
| C15H12O5 | 272.06847 | -0.281 | p-Coumaroyltriacetic acid lactone | HMDB: [-1]HMDB0304447 KEGG: C12087 |
| C15H12O5 | 272.06847 | -0.281 | 2',3',4',6'-Tetrahydroxychalcone | KNApSAcK: C00049932 |
| C15H12O5 | 272.06847 | -0.281 | 6,7,4'-Trihydroxyflavanone | KEGG: C16232 |
| C15H12O5 | 272.06847 | -0.281 | TMC 256C1 | KNApSAcK: C00015080 |
| C15H12O5 | 272.06847 | -0.281 | 4-Hydroxy-1,2-dimethoxy-xanthone | KNApSAcK: C00049558 |
| C15H12O5 | 272.06847 | -0.281 | 1-Hydroxy-7-hydroxymethyl-6-methoxyxanthone | KNApSAcK: C00045528 |
| C15H12O5 | 272.06847 | -0.281 | 6,7,4'-Trihydroxyisoflavanone | HMDB: HMDB0041698 KEGG: C22580 |
| C15H12O5 | 272.06847 | -0.281 | Wittifuran X | KNApSAcK: C00053894 |
| C15H12O5 | 272.06847 | -0.281 | 8-Hydroxy-6-methoxy-3,5-dimethylnaphtho[2,3-b]furan-4,9-dione | KNApSAcK: C00017459 |
| C15H12O5 | 272.06847 | -0.281 | 5,7-Dihydroxydehydroiso-alpha-lapachone | KNApSAcK: C00034771 |
| C15H12O5 | 272.06847 | -0.281 | Corynesidone A | KNApSAcK: C00048362 |
| C15H12O5 | 272.06847 | -0.281 | Xylariaquinone A | KNApSAcK: C00040707 |
| C15H12O5 | 272.06847 | -0.281 | 6-Methoxymicrominutinin | KNApSAcK: C00019959 |
| C15H12O5 | 272.06847 | -0.281 | Moracin J | HMDB: HMDB0033308 |
| C15H12O5 | 272.06847 | -0.281 | Protosappanin A | HMDB: HMDB0256874 |
| C15H12O5 | 272.06847 | -0.281 | Isopestacin | KNApSAcK: C00037337 |
| C15H12O5 | 272.06847 | -0.281 | 4-Hydroxy-2,3-dimethoxyxanthone | KNApSAcK: C00048290, C00048950 |
| C15H12O5 | 272.06847 | -0.281 | 3'-Hydroxydihydrodaidzein | HMDB: HMDB0041656 |
| C15H12O5 | 272.06847 | -0.281 | Rubrofusarin | KEGG: C09047 KNApSAcK: C00002445 |
| C15H12O5 | 272.06847 | -0.281 | Ebenfuran I | KNApSAcK: C00039078 |
| C15H12O5 | 272.06847 | -0.281 | 4-Methoxyphenanthrene-2,3,6,7-tetrol | KNApSAcK: C00040831 |
| C15H12O5 | 272.06847 | -0.281 | 2,4-Dimethoxy-3-hydroxyxanthone | KNApSAcK: C00029500 |
| C15H12O5 | 272.06847 | -0.281 | Gnetofuran C | KNApSAcK: C00044786 |
| C15H12O5 | 272.06847 | -0.281 | Dihydrogenistein | HMDB: HMDB0005897 KEGG: C14458 KNApSAcK: C00052508 |
| C15H12O5 | 272.06847 | -0.281 | Isotoralactone | KNApSAcK: C00051009 |
| C15H12O5 | 272.06847 | -0.281 | Microminutin | KNApSAcK: C00051601 |
| C15H12O5 | 272.06847 | -0.281 | 1,8-Dimethoxy-2-hydroxyxanthone | KNApSAcK: C00042030 |
| C15H12O5 | 272.06847 | -0.281 | Toralactone | HMDB: HMDB0038549 KEGG: C17673 KNApSAcK: C00032364 |
| C15H12O5 | 272.06847 | -0.281 | 5,6-Dehydromethysticin | KNApSAcK: C00029551 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 273.07578 |
| Splash: splash10-014j-0930000000-8f35809a093ca340af65 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 118.99 | 1651 | 154 | 1000 |
| 146.82 | 1019 | 126 | 617 |
| 150.98 | 495 | 122 | 300 |
| 243.09 | 467 | 30 | 282 |
| 255.14 | 440 | 18 | 266 |
| 122.99 | 355 | 150 | 214 |
| 245.08 | 324 | 28 | 196 |
| 139.02 | 140 | 134 | 84 |
| 106.98 | 128 | 166 | 77 |
| 231.16 | 96 | 42 | 58 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.294 | [2'-Hydroxychalcone]-A(3OH)-B(1OH) | 2'-Hydroxychalcone | 4,2',3',4'-Tetrahydroxychalcone |
| 0.278 | [Flavanone]-A(2OH)-B(1OH) | Flavanone | 7,8,4'-Trihydroxyflavanone |
| 0.267 | [Isoflavanone]-A(1OH)-B(2OH) | Isoflavanone | 2'-Hydroxydihydrodaidzein |
| 0.267 | [2'-Hydroxychalcone]-A(3OH)-B(1OH) | 2'-Hydroxychalcone | Naringenin chalcone |
| 0.250 | [Flavanone]-A(2OH)-B(1OH) | Flavanone | 5,8,4'-Trihydroxyflavanone |
| 0.250 | [Flavanone]-A(2OH)-B(1OH) | Flavanone | 5,7,2'-Trihydroxyflavanone |
| 0.250 | [Flavanone]-A(2OH)-B(1OH) | Flavanone | 5,7,3'-Trihydroxyflavanone |
| 0.250 | [Flavanone]-A(2OH)-B(1OH) | Flavanone | Naringenin |
| 0.231 | [Pterocarpan]-A(2OH)-B(1OH) | Pterocarpan | 4-Hydroxydemethylmedicarpin |
| 0.158 | [2'-Hydroxychalcone]-A(2OH)-B(2OH) | 2'-Hydroxychalcone | Pseudosindorin |
| 0.158 | [2'-Hydroxychalcone]-A(2OH)-B(2OH) | 2'-Hydroxychalcone | Butein |
| 0.158 | [2'-Hydroxychalcone]-A(2OH)-B(2OH) | 2'-Hydroxychalcone | 2,4,2',4'-Tetrahydroxychalcone |
| 0.154 | [Isoflavan]-A(1OH)-B(1OH, 1OMe) | Isoflavan | Vestitol |
| 0.154 | [Isoflavan]-A(1OH)-B(1OH, 1OMe) | Isoflavan | Isovestitol |
| 0.154 | [Isoflavan]-A(1OMe)-B(2OH) | Isoflavan | Neovestitol |
| 0.150 | [Flavanone]-A(1OH)-B(2OH) | Flavanone | Butin |
| 0.111 | [Flavanone]-A(3OH)-B(none) | Flavanone | Dihydrobaicalein |
| 0.111 | [Flavanone]-A(3OH)-B(none) | Flavanone | Dihydronorwogonin |
| 0.077 | [Dihydroflavonol]-A(2OH)-B(none) | Dihydroflavonol | Pinobanksin |
| 0.077 | [Dihydroflavonol]-A(1OH)-B(1OH) | Dihydroflavonol | Garbanzol |
| 0.071 | [Flavan 3-ol]-A(1OMe)-B(1OH) | Flavan 3-ol | Guibourtinidol-7-methyl ether |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(none) | Dihydrochalcone | Uvangoletin |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(none) | Dihydrochalcone | 2',6'-Dihydroxy-4'-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(1OH, 1OMe) | Dihydrochalcone | Loureirin C |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(1OH, 1OMe) | Dihydrochalcone | 2,4'-Dihydroxy-4-methoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(1OH, 1OMe)-B(1OH) | Dihydrochalcone | 4'-O-Methyldavidigenin |
| 0.000 | [beta-Hydroxy(or Oxodihydro)chalcone]-A(2OH)-B(1OH) | beta-Hydroxy(or Oxodihydro)chalcone | Licodione |
| 0.000 | [beta-Hydroxy(or Oxodihydro)chalcone]-A(3OH)-B(none) | beta-Hydroxy(or Oxodihydro)chalcone | 2',4',6',beta-Tetrahydroxychalcone |
| 0.000 | [Dihydrochalcone]-A(3OH, 1Methyl)-B(none) | Dihydrochalcone | 3'-Methyl-2',4',6'-trihydroxydihydrochalcone |
| 0.000 | [2-Hydroxyflavanone]-A(2OH)-B(none) | 2-Hydroxyflavanone | 2,5,7-Trihydroxyflavanone (2beta) |
| 0.000 | [Flavan]-A(1OMe)-B(2OH) | Flavan | 3',4'-Dihydroxy-7-methoxyflavan |
| 0.000 | [Flavan]-A(1OH)-B(1OH, 1OMe) | Flavan | 7,4'-Dihydroxy-3'-methoxyflavan |
| 0.000 | [Flavan]-A(1OH)-B(1OH, 1OMe) | Flavan | 7,3'-Dihydroxy-4'-methoxyflavan |
| 0.000 | [Flavan]-A(2OH)-B(1OMe) | Flavan | 5,7-Dihydroxy-4'-methoxyflavan |
| 0.000 | [Pterocarpan-6a-ol]-A(1OH)-B(1OH) | Pterocarpan-6a-ol | Glycinol |
| 0.000 | [alpha-Methyldeoxybenzoin]-A(2OH)-B(1OMe) | alpha-Methyldeoxybenzoin | Angolensin |