ピーク情報
|
イチョウ 葉
pos
|
| Peak #5875 MN MID: SE205_S01_M90 |
| m/z: 426.17603, RT: 55.37, 強度: 15834, ログ強度: 0.65, アダクト: [M+NH4]+, 共有数（同様のピークを含むサンプル数）: 1 |
| DB検索結果: (17 names) 7-O-Methylaloesin;(-)-7-O-Methylaloesin;Vilmorinine A;(+)-Vilmorinine A;Phellodenol G;Praeroside V;5,3',4'-Trihydroxybibenzyl 2-O-beta-D-glucopyranoside;Torachrysone 8-glucoside;Ginkgolide A;Fortunean... |
| DBごとのヒット数: ALL 14 KG 2 KN 10 HM 2 |
| FlavonoidSearch最大スコア MS2: -, MS3: 0.034 |
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 |
|---|---|---|---|---|
| C20H24O9 | 408.14203 | 0.419 | 7-O-Methylaloesin | KNApSAcK: C00036661 |
| C20H24O9 | 408.14203 | 0.419 | Vilmorinine A | KNApSAcK: C00050313 |
| C20H24O9 | 408.14203 | 0.419 | Praeroside V | KNApSAcK: C00020036 |
| C20H24O9 | 408.14203 | 0.419 | Phellodenol G | KNApSAcK: C00030984 |
| C20H24O9 | 408.14203 | 0.419 | 5,3',4'-Trihydroxybibenzyl 2-O-beta-D-glucopyranoside | KNApSAcK: C00015568 |
| C20H24O9 | 408.14203 | 0.419 | Torachrysone 8-O-beta-D-glucoside | HMDB: HMDB0038600 KNApSAcK: C00045112 |
| C20H24O9 | 408.14203 | 0.419 | Ginkgolide A | HMDB: HMDB0036862 KEGG: C07601 KNApSAcK: C00003429 LipidMAPS: LMPR0104540001 |
| C20H24O9 | 408.14203 | 0.419 | Fortuneanoside C | KNApSAcK: C00030320 |
| C20H24O9 | 408.14203 | 0.419 | 3-[2-[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl]-2,3-dihydrofuro[3,2-g]chromen-7-one | HMDB: HMDB0258151 |
| C20H24O9 | 408.14203 | 0.419 | Pasakbumin-A | HMDB: HMDB0252131 |
| C20H24O9 | 408.14203 | 0.419 | Praeroside IV | KNApSAcK: C00020010 |
| C20H24O9 | 408.14203 | 0.419 | Abruquinone G | KNApSAcK: C00050525 |
| C20H24O9 | 408.14203 | 0.419 | Columbianetin-beta-D-glucopyranoside | KNApSAcK: C00019822 |
| C20H24O9 | 408.14203 | 0.419 | Nodakenin | HMDB: HMDB0041508 KEGG: C09279 KNApSAcK: C00002486, C00029680 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 426.17557 |
| Splash: splash10-0a4i-0000900000-d46ef75beecb1e8e29e9 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 409.13 | 46378 | 17 | 1000 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 409.12949 |
| Splash: splash10-02ft-0009000000-b2e71c77ee8d66941dcb |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 345.11 | 7096 | 64 | 1000 |
| 363.19 | 5751 | 46 | 810 |
| 373.10 | 4135 | 36 | 582 |
| 317.07 | 3024 | 92 | 426 |
| 391.14 | 2072 | 18 | 292 |
| 319.17 | 1790 | 90 | 252 |
| 327.19 | 1522 | 82 | 214 |
| 331.23 | 933 | 78 | 131 |
| 329.12 | 924 | 80 | 130 |
| 299.13 | 786 | 110 | 110 |
| 301.19 | 761 | 108 | 107 |
| 355.22 | 689 | 54 | 97 |
| 305.10 | 658 | 104 | 92 |
| 347.20 | 656 | 62 | 92 |
| 281.13 | 641 | 128 | 90 |
| 283.19 | 527 | 126 | 74 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.087 | [Dihydroflavonol]-A(1OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl)) | Dihydroflavonol | 3-Hydroxyglabrol |
| 0.034 | [Flavanone]-A(2OH)-B(1OH, 2(C-Prenyl)) | Flavanone | Abyssinone V |
| 0.034 | [Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH) | Flavanone | 6,8-Diprenylnaringenin |
| 0.034 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl)) | Flavanone | Euchrestaflavanone A |
| 0.034 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl)) | Flavanone | Macarangaflavanone B |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(3,7-Dimethyl-6-hydroxyocta-2,7-dienyl))-B(1OH) | 2'-Hydroxychalcone | Xanthoangelol B |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(2-hydroxy-3-methyl-3-butenyl)) | 2'-Hydroxychalcone | Paratocarpin D |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH, 1(C-Prenyl)) | 2'-Hydroxychalcone | Paratocarpin E |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH, 1(C-Prenyl)) | 2'-Hydroxychalcone | Bartericin A |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(2-hydroxy-3-methyl-3-butenyl)) | 2'-Hydroxychalcone | Bartericin D |
| 0.000 | [2'-Hydroxychalcone]-A(2OH)-B(1OH, 1(C-Prenyl), 1(2-hydroxy-3-methyl-3-butenyl)) | 2'-Hydroxychalcone | Anthyllin |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano))) | 2'-Hydroxychalcone | Bartericin C |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH, 1(C-Prenyl)) | 2'-Hydroxychalcone | Bartericin B |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1Geranyl)-B(2OH) | 2'-Hydroxychalcone | 3'-Geranyl-3,4,2',4'-tetrahydroxychalcone |
| 0.000 | [2'-Hydroxychalcone]-A(2OH)-B(2OH, 1Geranyl) | 2'-Hydroxychalcone | Kuwanol D |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1Lavandulyl)-B(2OH) | 2'-Hydroxychalcone | Ammothamnidin |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl), 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none) | 2'-Hydroxychalcone | Cedrediprenone |
| 0.000 | [2'-Hydroxychalcone]-A(3OH, 1Geranyl)-B(1OH) | 2'-Hydroxychalcone | 3'-Geranylchalconaringenin |
| 0.000 | [beta-Hydroxy(or Oxodihydro)chalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl)) | beta-Hydroxy(or Oxodihydro)chalcone | Glyinflanin A |
| 0.000 | [Dihydrochalcone]-A(2OH)-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano))) | Dihydrochalcone | 4,2',4'-Trihydroxy-6''-methyl-6''-(4-methyl-3-pentenyl)pyrano[2'',3'':3,2]dihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1(6-Isopropyl-3-methyl-2-cyclohexenyl))-B(none) | Dihydrochalcone | Methyllinderatin |
| 0.000 | [Flavanone]-A(1OH, 1Lavandulyl)-B(2OH) | Flavanone | Lehmannin |
| 0.000 | [Flavanone]-A(2OH, 1Lavandulyl)-B(1OH) | Flavanone | Kushenol A |
| 0.000 | [Flavanone]-A(2OH, 1(2-Isopropenyl-5-methyl-5-hexenyl))-B(1OH) | Flavanone | Remangiflavanone A |
| 0.000 | [Flavanone]-A(2OH, 1Geranyl)-B(1OH) | Flavanone | Bonannione A |
| 0.000 | [Flavanone]-A(2OH, 1Geranyl)-B(1OH) | Flavanone | Sophoraflavanone A |
| 0.000 | [Flavanone]-A(2OH)-B(1OH, 1Geranyl) | Flavanone | Macarangaflavanone A |
| 0.000 | [Flavanone]-A(2OH, 1Lavandulyl)-B(1OH) | Flavanone | Leachianone E |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano))) | Flavanone | Paratocarpin J |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1([2,3:@@]-(6,6-Dimethyldihydropyrano))) | Flavanone | Euchrenone a16 |
| 0.000 | [Flavone]-A(1OH, 1([2,3:@@]-(4-Methyl-5-hydoxy-3a,6a-dihydro-6-oxocyclopenta[b]furano)))-B(1OH, 1OMe) | Flavone | Torosaflavone C |
| 0.000 | [Dihydroflavonol]-A(2OH, 1Geranyl)-B(none) | Dihydroflavonol | 6-Geranylpinobanksin |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(1OH, 1(5-Formyl-2-hydroxyphenyl)) | Dihydroflavonol | 3'-(5''-formyl-2''-hydroxyphenyl)aromadendrin |
| 0.000 | [Flavonol (3-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano))) | Flavonol | 3,6-Dimethoxy-6'',6''-dimethyl-3',4'-methylenedioxypyrano[2,3:7,8]flavone |
| 0.000 | [Flavonol]-A(2OH, 1(p-Hydroxybenzyl))-B(2OH) | Flavonol | 8-p-Hydroxybenzylquercetin |
| 0.000 | [Isoflavone]-A(1([@@]-Methylenedioxy))-B(2OMe, 1([2,3:@@]-(6,6-Dimethylpyrano))) | Isoflavone | Ferrugone |
| 0.000 | [Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano))) | Isoflavone | Ichthynone |
| 0.000 | [Isoflavone]-A(2OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano))) | Isoflavone | 5-Methoxydurmillone |
| 0.000 | [Pterocarpan-6a-ol]-A(1OH, 1(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Pterocarpan-6a-ol | 2-Prenyl-6a-hydroxyphaseollidin |
| 0.000 | [Dehydrorotenone]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(2OMe) | Dehydrorotenone | Dehydroamorphigenin |
| 0.000 | [Dehydrorotenone]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe) | Dehydrorotenone | Villosol |
| 0.000 | [Dehydrorotenone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OMe) | Dehydrorotenone | Dehydrotoxicarol |
| 0.000 | [6-Hydroxydehydrorotenone]-A(1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe) | 6-Hydroxydehydrorotenone | Amorpholone |
| 0.000 | [4-Hydroxy-3-phenylcoumarin (4-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano))) | 4-Hydroxy-3-phenylcoumarin | Robustin methyl ether |
| 0.000 | [4-Hydroxy-3-phenylcoumarin (4-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([2,3:@@]-(6,6-Dimethylpyrano))) | 4-Hydroxy-3-phenylcoumarin | Isorobustin 4-methyl ether |
| 0.000 | [4-Hydroxy-3-phenylcoumarin (4-OMe)]-A(1OMe, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1([@@]-Methylenedioxy)) | 4-Hydroxy-3-phenylcoumarin | Glabrescin |
| 0.000 | [4-Hydroxy-3-phenylcoumarin]-A(2OMe, 1([2,3:@@]-(5-Isopropenylfurano)))-B(1OMe) | 4-Hydroxy-3-phenylcoumarin | Thonningine B |
| 0.000 | [4-phenylcoumarin]-A(1OH, 1Isobutyroyl, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(none) | 4-phenylcoumarin | 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(isobutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one |
| 0.000 | [4-phenylcoumarin]-A(1OH, 1Butyroyl, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(none) | 4-phenylcoumarin | 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(butyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one |