ピーク情報
|
（くり類） 日本ぐり 生
pos
|
| Peak #3723 MN MID: SE123_S050101_M90 |
| m/z: 347.14887, RT: 48.39, 強度: 7479, ログ強度: 0.46, 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: (65 names) Dihydrokanakugiol;3-Hydroxy-2,4,6,7,8-pentamethoxy-9,10-dihydrophenanthrene;Gibberellin A126;Sorgomol;Repdiolide;[3aS-(3aalpha,4beta,5beta,6alpha,7alpha,7abeta)]-6-Ethenyl-5-(1-formylethenyl)octahydro... |
| DBごとのヒット数: ALL 59 KG 10 KN 42 HM 6 LM 1 |
| FlavonoidSearch最大スコア MS2: 0.333, 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 |
|---|---|---|---|---|
| C19H22O6 | 346.14164 | -0.131 | Dihydrokanakugiol | FlavonoidViewer: FL1DG9NS0002 KNApSAcK: C00007946 LipidMAPS: LMPK12120563 |
| C19H22O6 | 346.14164 | -0.131 | 3-Hydroxy-2,4,6,7,8-pentamethoxy-9,10-dihydrophenanthrene | KNApSAcK: C00015426 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A126 | HMDB: HMDB0038314 KNApSAcK: C00007868 |
| C19H22O6 | 346.14164 | -0.131 | Sorgomol | KNApSAcK: C00053790 |
| C19H22O6 | 346.14164 | -0.131 | [3aS-(3aalpha,4beta,5beta,6alpha,7alpha,7abeta)]-6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid | KNApSAcK: C00011983 |
| C19H22O6 | 346.14164 | -0.131 | Repdiolide | KNApSAcK: C00020735 |
| C19H22O6 | 346.14164 | -0.131 | Diosbulbin E | HMDB: HMDB0036779 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A68 | HMDB: HMDB0035609 KNApSAcK: C00000068 |
| C19H22O6 | 346.14164 | -0.131 | Eremantholide C | KNApSAcK: C00012404 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A94 | HMDB: HMDB0031365 KNApSAcK: C00000294 |
| C19H22O6 | 346.14164 | -0.131 | Vernopectolide B | KNApSAcK: C00011857 |
| C19H22O6 | 346.14164 | -0.131 | Kingiolide | KNApSAcK: C00021119 |
| C19H22O6 | 346.14164 | -0.131 | Hallactone A | KEGG: C09104 KNApSAcK: C00000276 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A80 | HMDB: HMDB0036892 KNApSAcK: C00000080 |
| C19H22O6 | 346.14164 | -0.131 | 1,2-Dehydrozexbrevin | KNApSAcK: C00011882 |
| C19H22O6 | 346.14164 | -0.131 | Murrangatin acetate | KNApSAcK: C00051671 |
| C19H22O6 | 346.14164 | -0.131 | Tomenphantin B | KNApSAcK: C00049405 |
| C19H22O6 | 346.14164 | -0.131 | [3aS-(3aalpha,4beta,5beta,6alpha,7abataethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid | KNApSAcK: C00011982 |
| C19H22O6 | 346.14164 | -0.131 | 19-Deoxyjanerin | KNApSAcK: C00020594 |
| C19H22O6 | 346.14164 | -0.131 | Junosmarin | HMDB: HMDB0033290 KNApSAcK: C00051087 |
| C19H22O6 | 346.14164 | -0.131 | 8alpha-Acetoxyzaluzanin D | KNApSAcK: C00020506 |
| C19H22O6 | 346.14164 | -0.131 | (+)-Taxiresinol | HMDB: HMDB0258751 KNApSAcK: C00007200 |
| C19H22O6 | 346.14164 | -0.131 | Zexbrevin | KNApSAcK: C00012113 |
| C19H22O6 | 346.14164 | -0.131 | Cynaropicrin | HMDB: HMDB0036423 KEGG: C09385, C09547 KNApSAcK: C00003243, C00003366 |
| C19H22O6 | 346.14164 | -0.131 | Antheridic acid | KEGG: C09062 |
| C19H22O6 | 346.14164 | -0.131 | 3,4,7-Trihydroxy-5,4'-dimethoxy-6,8-dimethylflavan | FlavonoidViewer: FL6DBBNM0001 KNApSAcK: C00009024 LipidMAPS: LMPK12020214 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A3 | HMDB: HMDB0003559, HMDB0252716 KEGG: C01699 KNApSAcK: C00000003 LipidMAPS: LMPR0104170002 |
| C19H22O6 | 346.14164 | -0.131 | 8-Hydroxy-3',4',5',7-tetramethoxyflavan | HMDB: HMDB0040309 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A34-catabolite | HMDB: HMDB0304361 KEGG: C11869 LipidMAPS: LMPR0104170026 |
| C19H22O6 | 346.14164 | -0.131 | 8alpha-Epoxymethylacrylyloxyambrosin | KNApSAcK: C00038329 |
| C19H22O6 | 346.14164 | -0.131 | 9E-Millerenolide | KNApSAcK: C00011849 |
| C19H22O6 | 346.14164 | -0.131 | Ferupennin B | KNApSAcK: C00045933 |
| C19H22O6 | 346.14164 | -0.131 | Isotaxiresinol | HMDB: HMDB0253695 KNApSAcK: C00007207 |
| C19H22O6 | 346.14164 | -0.131 | Acroptin | KNApSAcK: C00020503 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A30 | HMDB: HMDB0303477 KNApSAcK: C00000030 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A29-catabolite | HMDB: HMDB0304360 KEGG: C11855 LipidMAPS: LMPR0104170012 |
| C19H22O6 | 346.14164 | -0.131 | Orobanchol | KNApSAcK: C00037587 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A22 | HMDB: HMDB0036891 KNApSAcK: C00000022 |
| C19H22O6 | 346.14164 | -0.131 | Cajucarinolide | KNApSAcK: C00042330 |
| C19H22O6 | 346.14164 | -0.131 | Strigol | HMDB: HMDB0036677 KEGG: C09190 KNApSAcK: C00003486 |
| C19H22O6 | 346.14164 | -0.131 | Hemistepsin | KNApSAcK: C00030468 |
| C19H22O6 | 346.14164 | -0.131 | Magnolianone | KNApSAcK: C00039711 |
| C19H22O6 | 346.14164 | -0.131 | 1,7-bis(3,4-Dihydroxyphenyl)-5-hydroxy-3-heptanone | KNApSAcK: C00031488 |
| C19H22O6 | 346.14164 | -0.131 | Ciliarin | KNApSAcK: C00012115 |
| C19H22O6 | 346.14164 | -0.131 | Diosbulbin G | HMDB: HMDB0036782 |
| C19H22O6 | 346.14164 | -0.131 | 1(10)E-Millerenolide | KNApSAcK: C00011848 |
| C19H22O6 | 346.14164 | -0.131 | LipidMAPS: LMPR0103090023 |
|
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A6 | HMDB: HMDB0303476 KEGG: C11856 KNApSAcK: C00000006 LipidMAPS: LMPR0104170013 |
| C19H22O6 | 346.14164 | -0.131 | Ponalactone A | KEGG: C09174 KNApSAcK: C00000278 |
| C19H22O6 | 346.14164 | -0.131 | Gibberellin A92 | HMDB: HMDB0040648 KNApSAcK: C00000224 |
| C19H22O6 | 346.14164 | -0.131 | Alectrol | HMDB: HMDB0041372 |
| C19H22O6 | 346.14164 | -0.131 | Cedrusin | KNApSAcK: C00053131 |
| C19H22O6 | 346.14164 | -0.131 | 5'-Hydroxy-3',4',7,8-tetramethoxyflavan | HMDB: HMDB0040310 |
| C19H22O6 | 346.14164 | -0.131 | Brittonin B | KNApSAcK: C00015297 |
| C19H22O6 | 346.14164 | -0.131 | Molephantin | KEGG: C09512 KNApSAcK: C00003333 |
| C20H18O2N4 | 346.14298 | -3.995 | Lepidine E | HMDB: HMDB0033095 KNApSAcK: C00028462 |
| C20H18O2N4 | 346.14298 | -3.995 | Lepidine F | HMDB: HMDB0033094 |
| C20H18O2N4 | 346.14298 | -3.995 | Lepidine D | HMDB: HMDB0032716 KNApSAcK: C00028461 |
| C20H18O2N4 | 346.14298 | -3.995 | Lepidine B | HMDB: HMDB0032715 KNApSAcK: C00028459 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 347.14883 |
| Splash: splash10-001i-0009000000-27d2651d2e71b9fa6091 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 331.01 | 4701 | 16 | 1000 |
| 313.17 | 996 | 34 | 211 |
| 303.05 | 812 | 44 | 172 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',4'-Tetrahydroxy-6,5'-dimethoxyflavone |
| 0.333 | [Flavone]-A(1OH, 2OMe)-B(3OH) | Flavone | 5,3',4',5'-Tetrahydroxy-6,7-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',4'-Tetrahydroxy-6,5'-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | Ganhuangenin |
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',3'-Tetrahydroxy-8,6'-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,3',5'-Tetrahydroxy-8,4'-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 1OMe)-B(2OH, 1OMe) | Flavone | 5,7,2',4'-Tetrahydroxy-8,5'-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,6,2',6'-Tetrahydroxy-7,8-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | Leucanthogenin |
| 0.333 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,7,3',4'-Tetrahydroxy-6,8-dimethoxyflavone |
| 0.333 | [Flavone]-A(2OH, 2OMe)-B(2OH) | Flavone | 5,6,3',4'-Tetrahydroxy-7,8-dimethoxyflavone |
| 0.000 | [Flavanone]-A(1OH, 3OMe)-B(1OH) | Flavanone | 5,4'-Dihydroxy-6,7,8-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 2OMe) | Flavanone | 5,2'-Dihydroxy-7,4',5'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(2OH, 2OMe)-B(1OMe) | Flavanone | 5,6-Dihydroxy-7,8,4'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-6,7,6'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,3'-Dihydroxy-6,7,4'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | Agestricin D |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-7,8,6'-trimethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavanone | 5,3'-Dihydroxy-7,8,4'-trimethoxyflavanone |
| 0.000 | [Dihydrochalcone]-A(1OH, 4OMe)-B(none) | Dihydrochalcone | Dihydrokanakugiol |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OH) | 2'-Hydroxychalcone | Hamilcone |
| 0.000 | [Flavonol]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Inucrithmin |
| 0.000 | [Flavonol]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Myricetin 7,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Myricetin 3',4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Syringetin |
| 0.000 | [Flavonol]-A(2OH)-B(1OH, 2OMe) | Flavonol | Viscidulin III |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Spinacetin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Laciniatin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Quercetagetin 7,3'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 3',8-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 7,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Limocitrin |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 8,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(2OH) | Flavonol | Eupatolitin |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(2OH) | Flavonol | Zanthoxyl flavone |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 2OMe) | Pterocarpan | 2,8-Dihydroxy-3,9,10-trimethoxypterocarpan |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1([@@]-Methylenedioxy))-B(1OMe) | Dihydrochalcone | 2',6'-Dihydroxy-4,3'-dimethoxy-4',5'-methylenedioxydihydrochalcone |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(2OH)-C(1(O-Acetyl)) | Dihydroflavonol | Taxifolin 3-O-acetate |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | Myricetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | Artemexitin |
| 0.000 | [Flavonol]-A(2OH, 1Methyl)-B(2OH, 1OMe) | Flavonol | Dumosol |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1Methyl)-B(3OH) | Flavonol | Alluaudiol |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | 5,7,4',5'-Tetrahydroxy-3,2'-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH, 1OMe) | Flavonol | 5,7,2',5'-Tetrahydroxy-3,4'-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,3'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Axillarin |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Tomentin |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,3'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | 7,8,3',4'-Trihydroxy-3,5-dimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Gossypetin 3,7-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OH) | Flavonol | Gossypetin 3,8-dimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH, 1OMe)-B(1OH) | Flavonol | 5,7,8,4'-Tetrahydroxy-3,6-dimethoxyflavone |
| 0.000 | [Flavan 3,4-diol]-A(1OH, 1OMe, 2Methyl)-B(1OMe) | Flavan 3,4-diol | 3,4,7-Trihydroxy-5,4'-dimethoxy-6,8-dimethylflavan |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(1OH, 1OMe)-B(2OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Amorphaquinone |