ピーク情報
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イヌカタヒバ
pos
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| Peak #8770 MN MID: SE205_S02_M90 |
| m/z: 502.29305, RT: 78.40, 強度: 19461, ログ強度: 0.77, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 4 |
| DB検索結果: (11 names) LysoPE(20:4(8Z,11Z,14Z,17Z)/0:0);LysoPE(0:0/20:4(5Z,8Z,11Z,14Z));Glycerophospho-N-Arachidonoyl Ethanolamine;LysoPE(0:0/20:4(8Z,11Z,14Z,17Z));LysoPE(20:4(5Z,8Z,11Z,14Z)/0:0);Fexofenadine;Paspalitrem C;... |
| DBごとのヒット数: ALL 10 KG 2 KN 3 HM 1 LM 4 |
| FlavonoidSearch最大スコア MS2: -, MS3: 0.041 |
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 |
|---|---|---|---|---|
| C25H44O7NP | 501.28554 | 0.473 | LysoPE(20:4(8Z,11Z,14Z,17Z)/0:0) | HMDB: HMDB0011518 LipidMAPS: LMGP02050067 |
| C25H44O7NP | 501.28554 | 0.473 | LysoPE(0:0/20:4(5Z,8Z,11Z,14Z)) | HMDB: HMDB0011487 LipidMAPS: LMGP02050051 |
| C25H44O7NP | 501.28554 | 0.473 | Glycerophospho-N-Arachidonoyl Ethanolamine | HMDB: HMDB0252848 |
| C25H44O7NP | 501.28554 | 0.473 | LysoPE(0:0/20:4(8Z,11Z,14Z,17Z)) | HMDB: HMDB0011488 LipidMAPS: LMGP02050052 |
| C25H44O7NP | 501.28554 | 0.473 | LysoPE(20:4(5Z,8Z,11Z,14Z)/0:0) | HMDB: HMDB0011517 LipidMAPS: LMGP02050009 |
| C32H39O4N | 501.28791 | -4.251 | Fexofenadine | HMDB: HMDB0005030 KEGG: C06999 |
| C32H39O4N | 501.28791 | -4.251 | Paspalitrem C | KNApSAcK: C00023589 |
| C32H39O4N | 501.28791 | -4.251 | beta-Aflatrem | KNApSAcK: C00023586 |
| C32H39O4N | 501.28791 | -4.251 | Aflatrem | KEGG: C20555 KNApSAcK: C00023585 |
| C32H39O4N | 501.28791 | -4.251 | Paspalitrem A | KNApSAcK: C00023587 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 502.29254 |
| Splash: splash10-03di-0009000000-2e1efb1a1f2e621296c3 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 361.27 | 7240 | 141 | 1000 |
| 484.22 | 414 | 18 | 57 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 361.27124 |
| Splash: splash10-02h0-0920000000-dafdc6d9122a6ae140e5 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 187.08 | 353 | 174 | 1000 |
| 269.33 | 332 | 92 | 940 |
| 161.14 | 323 | 200 | 914 |
| 199.11 | 311 | 162 | 881 |
| 171.11 | 293 | 190 | 831 |
| 133.09 | 285 | 228 | 806 |
| 159.11 | 283 | 202 | 801 |
| 185.14 | 283 | 176 | 801 |
| 173.06 | 272 | 188 | 770 |
| 130.96 | 270 | 230 | 765 |
| 203.13 | 243 | 158 | 688 |
| 147.12 | 233 | 214 | 661 |
| 121.05 | 222 | 240 | 629 |
| 145.04 | 206 | 216 | 583 |
| 189.18 | 192 | 172 | 544 |
| 134.99 | 172 | 226 | 488 |
| 213.12 | 169 | 148 | 479 |
| 201.20 | 166 | 160 | 469 |
| 227.12 | 161 | 134 | 455 |
| 175.06 | 136 | 186 | 384 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.069 | [Flavanone]-A(1OH, 3OMe)-B(1OMe) | Flavanone | 5-Hydroxy-6,7,8,4'-tetramethoxyflavanone |
| 0.059 | [Flavonol]-A(1OH, 3OMe)-B(1OH) | Flavonol | 3,5,4'-Trihydroxy-6,7,8-trimethoxyflavone |
| 0.036 | [2'-Hydroxychalcone]-A(2OH, 3OMe)-B(1OMe) | 2'-Hydroxychalcone | 2',5'-Dihydroxy-4,3',4',6'-tetramethoxychalcone |
| 0.033 | [Chalcone]-A(1OH, 4OMe)-B(1OH) | Chalcone | 4,3'-Hydroxy-2',4',5',6'-methoxychalcone |
| 0.000 | [Flavone]-A(2OH)-B(1OH, 3OMe) | Flavone | 5,7,3'-Trihydroxy-2',4',5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH)-B(1OH, 3OMe) | Flavone | 5,7,4'-Trihydroxy-2',3',5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavone | 5,7,4'-Trihydroxy-6,3',5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavone | 5,7,3'-Trihydroxy-6,4',5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 2OMe)-B(2OH, 1OMe) | Flavone | 5,3',5'-Trihydroxy-6,7,4'-trimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 2OMe)-B(2OH, 1OMe) | Flavone | 5,3',4'-Trihydroxy-6,7,5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 2OMe)-B(2OH, 1OMe) | Flavone | Arcapillin |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(1OH, 2OMe) | Flavone | 5,7,3'-Trihydroxy-8,4',5'-trimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 3OMe)-B(2OH) | Flavone | 5,2',5'-Trihydroxy-6,7,8-trimethoxyflavone |
| 0.000 | [Flavone]-A(1OH, 3OMe)-B(2OH) | Flavone | 5,2',6'-Trihydroxy-6,7,8-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | 5,6,2'-Trihydroxy-7,8,6'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | Sudachitin |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | Acerosin |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | Isothymonin |
| 0.000 | [Flavone]-A(1OH, 3OMe)-B(2OH) | Flavone | Sideritiflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | 5,7,4'-Trihydroxy-6,8,3'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | 5,7,3'-Trihydroxy-6,8,4'-trimethoxyflavone |
| 0.000 | [Flavone]-A(2OH, 2OMe)-B(1OH, 1OMe) | Flavone | Thymonin |
| 0.000 | [Flavone]-A(1OH, 3OMe)-B(2OH) | Flavone | Tamadone |
| 0.000 | [Isoflavone]-A(2OH, 1OMe)-B(1OH, 2OMe) | Isoflavone | 5,7,4'-Trihydroxy-6,3',5'-trimethoxyisoflavone |
| 0.000 | [Isoflavone]-A(2OH, 1OMe)-B(1OH, 2OMe) | Isoflavone | Irigenin |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(3OMe) | Flavanone | 5-Hydroxy-7,3',4',5'-tetramethoxyflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe)-B(3OMe) | Flavanone | Heteroflavanone A |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(2OMe) | Flavanone | Agestricin C |
| 0.000 | [Flavanone]-A(1OH, 2OMe)-B(2OMe) | Flavanone | 5-Hydroxy-6,7,3',4'-tetramethoxyflavanone |
| 0.000 | [Flavanone]-A(3OMe)-B(1OH, 1OMe) | Flavanone | Agecorynin E |
| 0.000 | [Flavonol]-A(2OH)-B(3OMe) | Flavonol | 3,5,7-Trihydroxy-2',4',5'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(2OMe) | Flavonol | Quercetagetin 6,3',4'-trimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(2OMe) | Flavonol | Quercetagetin 7,3',4'-trimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(2OMe) | Flavonol | 3,5,8-Trihydroxy-7,2',3'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(2OH, 1OMe)-B(2OMe) | Flavonol | Gossypetin 8,3',4'-trimethyl ether |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavonol | Veronicafolin |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavonol | Eupatin |
| 0.000 | [Flavonol]-A(1OH, 2OMe)-B(1OH, 1OMe) | Flavonol | 3,5,2'-Trihydroxy-7,8,4'-trimethoxyflavone |
| 0.000 | [Flavonol]-A(1OH, 1OMe)-B(1OH, 2OMe) | Flavonol | Myricetin 7,3',4'-trimethyl ether |
| 0.000 | [Pterocarpan]-A(2OMe)-B(1OH, 2OMe) | Pterocarpan | 8-Hydroxy-3,4,9,10-tetramethoxypterocarpan |
| 0.000 | [Dihydrochalcone]-A(2OH)-B(1OH, 1(2,3-Dihydroxy-3-methylbutyl)) | Dihydrochalcone | Brosimacutin H |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(2OH, 1(2,3-Dihydroxy-3-methylbutyl)) | Dihydrochalcone | Brosimacutin I |
| 0.000 | [Flavanone]-A(2OH, 2Methyl)-B(1OH, 2OMe) | Flavanone | 5,7,3'-Trihydroxy-4',5'-dimethoxy-6,8-di-C-methylflavanone |
| 0.000 | [Flavanone]-A(2OH, 1OMe)-B(1OMe, 1([@@]-Methylenedioxy)) | Flavanone | Agamanone |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(1OH, 1OMe)-C(1(O-Acetyl)) | Dihydroflavonol | Dihydroisorhamnetin 3-O-acetate |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe)-B(2OH)-C(1(O-Acetyl)) | Dihydroflavonol | Padmatin 3-O-acetate |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)-C(1(O-Acetyl)) | Dihydroflavonol | 6-Methoxyaromadendrin 3-O-acetate |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)-C(1(O-Acetyl)) | Dihydroflavonol | 3,5,7,4'-Tetrahydroxy-8-methoxyflavanone 3-O-acetate |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(1OH, 2OMe) | Flavonol | Myricetin 3,3',4'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(1OH, 2OMe) | Flavonol | Myricetin 3,3',5'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | 7,4',5'-Trihydroxy-3,5,3'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Myricetin 3,7,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Myricetin 3,7,4'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1Methyl)-B(2OH, 1OMe) | Flavonol | 6-C-Methylmyricetin 3,4'-dimethyl ether |
| 0.000 | [Flavonol]-A(2OH, 2Methyl)-B(2OH, 1OMe) | Flavonol | 6,8-Di-C-methylmyricetin 4'-methyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(3OH) | Flavonol | 6,8-Di-C-methylmyricetin 3-methyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Oxyayanin A |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Chrysosplenol F |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1OMe)-B(2OH, 1OMe) | Flavonol | Apuleidin |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | 5,2',3'-Trihydroxy-3,6,7-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Jaceidin |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Chrysosplenol C |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Centaureidin |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | Quercetagetin 3,5,7-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,6,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,6,4'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | Chrysosplenol D |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Quercetagetin 3,7,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Oxyayanin-B |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | 5,2',3'-Trihydroxy-3,7,8-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | 5,7,2'-Trihydroxy-3,6,4'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | 5,2',5'-Trihydroxy-3,7,8-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,7,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 2OMe)-B(2OH) | Flavonol | Gossypetin 3,7,8-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 1OMe)-B(1OH, 1OMe) | Flavonol | Gossypetin 3,8,3'-trimethyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(3OH, 1OMe)-B(1OMe) | Flavonol | 5,7,8-Trihydroxy-3,6,4'-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH) | Flavonol | 5,8,4'-Trihydroxy-3,6,7-trimethoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OH) | Flavonol | Sarothrin |
| 0.000 | [Flavan 3-ol]-A(1OH, 1([2,3:@@]-(6-Hydroxy-4-methyldihydropyrano)))-B(2OH) | Flavan 3-ol | Pyranochromene |
| 0.000 | [CCS-type derivative / [3,2']-Epoxydimethylmethanoflavan]-A(2OH)-B(2OH, 1OMe) | CCS-type derivative / [3,2']-Epoxydimethylmethanoflavan | Elaeocyanidin |
| 0.000 | [Flavan 3,4-diol (3,4-OMe)]-A(1OMe)-B(2OMe) | Flavan 3,4-diol | Fisetinidol-4beta-ol 3,4,7,3',4'-pentamethyl ether |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(2OMe)-B(2OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Abruquinone A |