ピーク情報
|
イネ 葉 ニッポンバレ
pos
|
| Peak #4546 MN MID: SE199_S41_M90 |
| m/z: 401.15975, RT: 50.55, 強度: 38825, ログ強度: 1.00, 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: (42 names) Kasanosin C;Arizonicanol C;5,7,3'-Trihydroxy-2',4'-dimethoxy-6-prenylisoflavanone;(+)-Aschantin;Deoxylophotoxin;Secundiflorol E;[2-(4-Acetoxy-3-methoxy-phenyl)-7-methoxy-5-methyl-2,3-dihydrobenzofuran... |
| DBごとのヒット数: ALL 32 KG 2 KN 26 HM 4 |
| FlavonoidSearch最大スコア MS2: 0.077, MS3: 0.188 |
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 |
|---|---|---|---|---|
| C22H24O7 | 400.15220 | 0.671 | Kasanosin C | KNApSAcK: C00053408 |
| C22H24O7 | 400.15220 | 0.671 | Arizonicanol C | KNApSAcK: C00018913 |
| C22H24O7 | 400.15220 | 0.671 | (+)-Aschantin | KEGG: C17845 KNApSAcK: C00029279, C00043134 |
| C22H24O7 | 400.15220 | 0.671 | Deoxylophotoxin | KNApSAcK: C00041494 |
| C22H24O7 | 400.15220 | 0.671 | Secundiflorol E | KNApSAcK: C00021678 |
| C22H24O7 | 400.15220 | 0.671 | [2-(4-Acetoxy-3-methoxy-phenyl)-7-methoxy-5-methyl-2,3-dihydrobenzofuran-3-yl]methyl acetate | HMDB: HMDB0252560 |
| C22H24O7 | 400.15220 | 0.671 | Pyramidatin F | KNApSAcK: C00037705 |
| C22H24O7 | 400.15220 | 0.671 | Hemiariensin | HMDB: HMDB0029869 |
| C22H24O7 | 400.15220 | 0.671 | 7beta-Acetoxy-8(17)-dehydroisochiliolide lactone | KNApSAcK: C00022554 |
| C22H24O7 | 400.15220 | 0.671 | Isoyatein | HMDB: HMDB0033258 |
| C22H24O7 | 400.15220 | 0.671 | Isotirumalin | FlavonoidViewer: FL4DCENI0001 KNApSAcK: C00008642 |
| C22H24O7 | 400.15220 | 0.671 | Aschantin | KNApSAcK: C00029744 |
| C22H24O7 | 400.15220 | 0.671 | Italipyrone | HMDB: HMDB0041307 |
| C22H24O7 | 400.15220 | 0.671 | Scariosin | FlavonoidViewer: FL4DCDNI0001 KNApSAcK: C00008641 |
| C22H24O7 | 400.15220 | 0.671 | Heteroclitin G | KNApSAcK: C00024182 |
| C22H24O7 | 400.15220 | 0.671 | Richardianidin 1 | KNApSAcK: C00023463 |
| C22H24O7 | 400.15220 | 0.671 | Valafolone | FlavonoidViewer: FL1CG9NI0003 KNApSAcK: C00007119 LipidMAPS: LMPK12120358 |
| C22H24O7 | 400.15220 | 0.671 | 7-Hydroxy-6,8-di-C-methylflavanone 7-O-arabinoside | FlavonoidViewer: FL2F19GM0001 KNApSAcK: C00008397 LipidMAPS: LMPK12140005 |
| C22H24O7 | 400.15220 | 0.671 | Dihydroanhydropodorhizol | KEGG: C10557 KNApSAcK: C00002598 |
| C22H24O7 | 400.15220 | 0.671 | Gomisin R | KNApSAcK: C00030418 |
| C22H24O7 | 400.15220 | 0.671 | Chrysophyllon I A | KNApSAcK: C00000593 |
| C22H24O7 | 400.15220 | 0.671 | Kenusanone E | FlavonoidViewer: FL2FALNI0015 KNApSAcK: C00008501 LipidMAPS: LMPK12140476 |
| C22H24O7 | 400.15220 | 0.671 | Brevicornin | FlavonoidViewer: FL5FABNI0003 KNApSAcK: C00013519 LipidMAPS: LMPK12110562 |
| C22H24O7 | 400.15220 | 0.671 | Crotozambefuran A | KNApSAcK: C00036943 |
| C22H24O7 | 400.15220 | 0.671 | (2R,3R)-3,5,4'-Trihydroxy-7,3'-dimethoxy-6-prenylflavanone | FlavonoidViewer: FL4DCDNI0002 KNApSAcK: C00014381 |
| C22H24O7 | 400.15220 | 0.671 | Tirumalin | FlavonoidViewer: FL4DCENI0002 KNApSAcK: C00008643 |
| C22H24O7 | 400.15220 | 0.671 | Falconensin I | KNApSAcK: C00048985 |
| C22H24O7 | 400.15220 | 0.671 | Melafolone | FlavonoidViewer: FL1CG9NI0002 KNApSAcK: C00007118 LipidMAPS: LMPK12120357 |
| C22H24O7 | 400.15220 | 0.671 | (-)-Santhemoidin A | KNApSAcK: C00011794 |
| C22H24O7 | 400.15220 | 0.671 | (+)-Alatumin | KNApSAcK: C00058822 |
| C22H24O7 | 400.15220 | 0.671 | Furaquinocin G | KNApSAcK: C00017087 |
| C22H24O7 | 400.15220 | 0.671 | (+)-Echinoisoflavanone | FlavonoidViewer: FLIBHXNI0002 KNApSAcK: C00009972 LipidMAPS: LMPK12050508 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 401.15918 |
| Splash: splash10-001i-0009000000-0487ec3865d08ee2ccfd |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 383.16 | 138335 | 18 | 1000 |
| 371.26 | 7181 | 30 | 51 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.077 | [Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Dihydroflavonol | 3,5,4'-Trihydroxy-7,3'-dimethoxy-6-prenylflavanone |
| 0.077 | [Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Dihydroflavonol | Isotirumalin |
| 0.077 | [Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Dihydroflavonol | Scariosin |
| 0.077 | [Dihydroflavonol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Dihydroflavonol | Tirumalin |
| 0.063 | [Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH, 1OMe) | Flavanone | Kenusanone E |
| 0.000 | [2'-Hydroxychalcone]-A(2OH)-B(1([2,3:@@]-(4-Formyl-5-(p-Hydroxyphenyl)furano))) | 2'-Hydroxychalcone | Lophirone D |
| 0.000 | [Flavanone]-A(1OMe)-B(1([2,3:@@]-(5-(p-Methoxyphenyl)furano))) | Flavanone | Lophirone J |
| 0.000 | [Flavone]-A(2OH, 1(C-Digitoxopyranosyl))-B(1OH) | Flavone | Torosaflavone A |
| 0.000 | [Flavone]-A(2OH, 1(C-(beta-D-Oliosyl))-B(1OH) | Flavone | 6-C-beta-D-Oliopyranosylapigenin |
| 0.000 | [Flavone]-A(2OH, 1(C-(beta-D-Boivinosyl))-B(1OH) | Flavone | 6-C-beta-D-Boivinopyranosylapigenin |
| 0.000 | [Flavone]-A(2OH, 1(C-(beta-D-Epioliosyl))-B(1OH) | Flavone | 6-C-beta-D-Epioliosylapigenin |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe)-B(1OH)-C(1(O-Angeloyl)) | Dihydroflavonol | 3,5,7,4'-Tetrahydroxy-8-methoxyflavanone 3-O-angelate |
| 0.000 | [Flavonol]-A(1OH, 1([2,3:@@]-(4-Phenyl-4,5-dihydro-6-oxopyrano)))-B(none) | Flavonol | 8-(2-Carboxy-1-phenylethyl)-3,5,7-trihydroxyflavone delta-lactone |
| 0.000 | [Flavonol]-A(2OH, 1(3-methylsuccinoyl))-B(1OH) | Flavonol | 3,5,7,4'-Tetrahydroxy-8-C-(3-methylsuccinoyl)flavone |
| 0.000 | [Flavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OMe) | Flavonol | Brevicornin |
| 0.000 | [Flavonol (3-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OMe, 1([@@]-Methylenedioxy)) | Flavonol | 3,5,3'-Trimethoxy-6,7:4',5'-bis(methylenedioxy)flavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OMe, 1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy)) | Flavonol | 3,5,8-Trimethoxy-6,7:3',4'-bis(methylenedioxy)flavone |
| 0.000 | [Isoflavanone-3-ol]-A(2OH)-B(2OMe, 1(C-Prenyl)) | Isoflavanone-3-ol | Echinoisoflavanone |
| 0.000 | [Coumestan]-A(1OH)-B(1OH, 1OMe, 1(2,3-Dihydroxy-3-methylbutyl)) | Coumestan | Mirificoumestan glycol |
| Level: 3, プリカーサーm/z: 383.16324 |
| Splash: splash10-0gb9-0019000000-72dfdd51148b5a602b92 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 368.12 | 32348 | 15 | 1000 |
| 351.15 | 29138 | 32 | 900 |
| 323.17 | 9872 | 60 | 305 |
| 319.15 | 6799 | 64 | 210 |
| 291.15 | 6468 | 92 | 199 |
| 350.29 | 4222 | 33 | 130 |
| 353.17 | 3160 | 30 | 97 |
| 352.20 | 3037 | 31 | 93 |
| 336.17 | 2814 | 47 | 87 |
| 229.04 | 2781 | 154 | 85 |
| 263.17 | 2497 | 120 | 77 |
| 308.11 | 1910 | 75 | 59 |
| 337.26 | 1757 | 46 | 54 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.188 | [Isoflavone]-A(1OH)-B(1OH, 2OMe, 1(C-Prenyl)) | Isoflavone | Licoricone |
| 0.188 | [Isoflavone]-A(1OH, 1OMe)-B(1OH, 1OMe, 1(C-Prenyl)) | Isoflavone | 7,3'-Dihydroxy-5,4'-dimethoxy-5'-prenylisoflavone |
| 0.188 | [Isoflavone]-A(2OH)-B(2OMe, 1(C-Prenyl)) | Isoflavone | Piscerythrinetin |
| 0.095 | [Flavone]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH, 1OMe) | Flavone | Artocarpetin B |
| 0.000 | [Pterocarpan]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH, 1OMe) | Pterocarpan | Desmodin |
| 0.000 | [CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(2OH)-B(2OH, 1OMe) | CCS-type derivative / [2',3]-Isopropenylethanoflavone | Artoindonesianin T |
| 0.000 | [CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1OMe)-B(2OH) | CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone | Artonin K |
| 0.000 | [Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(none)-C(1(O-Acetyl)) | Dihydroflavonol | 6-Prenylpinobanksin 3-O-acetate |
| 0.000 | [Flavonol]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(1OH, 1OMe) | Flavonol | Velloquercetin 4'-methyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH) | Flavonol | Velloquercetin 3-methyl ether |
| 0.000 | [Flavonol (3-OMe)]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH) | Flavonol | Sarothranol |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe, 1(C-Prenyl))-B(1([@@]-Methylenedioxy)) | Pterocarpan | Neoraucarpanol |
| 0.000 | [Pterocarpan]-A(1OMe, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1([@@]-Methylenedioxy)) | Pterocarpan | Neorautanin |
| 0.000 | [Pterocarpan-6a-ol]-A(1([2,3:@@]-(5-(1-Hydroxymethylvinyl)dihydrofurano)))-B(1([@@]-Methylenedioxy)) | Pterocarpan-6a-ol | Hildecarpidin |
| 0.000 | [12a-Hydroxyrotenone]-A(1OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy)) | 12a-Hydroxyrotenone | 12a-Hydroxypachyrrhizone |
| 0.000 | [12a-Hydroxyrotenone (3-OMe)]-A(1([2,3:@@]-Furano))-B(2OMe) | 12a-Hydroxyrotenone | Neobanone |
| 0.000 | [Coumaranochromon]-A(2OH)-B(2OH, 1(C-Prenyl)) | Coumaranochromon | Lisetin |
| 0.000 | [3-Phenylcoumarin]-A(2OMe, 1(C-Prenyl))-B(2OH) | 3-Phenylcoumarin | Glycyrin |
| Level: 3, プリカーサーm/z: 371.26016 |
| Splash: splash10-000i-0009000000-77c9673511cb7d065009 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 339.20 | 4001 | 32 | 1000 |
| 307.10 | 1050 | 64 | 262 |
| 311.25 | 399 | 60 | 99 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.040 | [Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH) | Flavonol | Gancaonin P |
| 0.040 | [Flavonol]-A(2OH)-B(2OH, 1(C-Prenyl)) | Flavonol | 2'-Prenylrhynchosin |
| 0.040 | [Flavonol]-A(2OH)-B(2OH, 1(C-Prenyl)) | Flavonol | Uralenol |
| 0.000 | [Flavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | Flavone | Torosaflavone D |
| 0.000 | [Dihydroflavonol]-A(2OH, 1OMe, 1(C-Prenyl))-B(none) | Dihydroflavonol | Dioclenol |
| 0.000 | [Flavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl)) | Flavanone | 5'-Prenylhomoeriodictyol |
| 0.000 | [Flavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl)) | Flavanone | 4'-Methylsigmoidin B |
| 0.000 | [Flavanone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH) | Flavanone | Dioflorin |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | Flavanone | Exiguaflavanone K |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH) | Flavanone | 5,3',4'-Trihydroxy-7-methoxy-8-C-prenylflavanone |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH) | Flavanone | Kenusanone I |
| 0.000 | [Isoflavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl)) | Isoflavanone | 3S-5,7,3'-Trihydroxy-4'-methoxy-5'-prenylisoflavanone |
| 0.000 | [Isoflavanone]-A(2OH)-B(1OH, 1OMe, 1(C-Prenyl)) | Isoflavanone | Sophoraisoflavanone A |
| 0.000 | [Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | Isoflavanone | 4'-O-Methylkievitone |
| 0.000 | [Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe) | Isoflavanone | Diphysolidone |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1OMe, 1(2-Hydroperoxy-3-methyl-3-butenyl))-B(1OH) | 2'-Hydroxychalcone | Xanthoangelol E |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH) | 2'-Hydroxychalcone | Xanthohumol D |
| 0.000 | [2'-Hydroxychalcone]-A(1OH, 1OMe, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH) | 2'-Hydroxychalcone | Dehydrocycloxanthohumol hydratechalcone |
| 0.000 | [Dihydrochalcone]-A(1OH, 2OMe, 1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy)) | Dihydrochalcone | 2'-Hydroxy-5',6'-dimethoxy-3,4-methylenedioxyfurano[2'',3'':4',3'] dihydrochalcon |
| 0.000 | [Flavanone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OMe) | Flavanone | 5,7-Dihydroxy-4'-methoxy-8-C-(2-hydroxy-3-methyl-3-butenyl)flavanone |
| 0.000 | [Flavanone]-A(2OH, 1(1,1-Dimethylallyl))-B(1OH, 1OMe) | Flavanone | 5,7,4'-Trihydroxy-3'-methoxy-6-(1,1-dimethylallyl)flavanone |
| 0.000 | [Flavone]-A(2OH, 1(3-Hydroxy-3-methyl-1-butenyl))-B(2OH) | Flavone | Oxidihydroartocarpesin |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe, 1Methyl)-B(1OH) | Dihydroflavonol | 5,7,4'-Trihydroxy-5-methoxy-8-prenylflavanone |
| 0.000 | [Dihydroflavonol]-A(1OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(2OH) | Dihydroflavonol | 7,8-Dihydrooxepinodihydroquercetin |
| 0.000 | [Dihydroflavonol]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OH) | Dihydroflavonol | Shuterone A |
| 0.000 | [Flavonol]-A(2OH)-B(1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano))) | Flavonol | Glycyrrhiza flavonol A |
| 0.000 | [Flavonol (3-OMe)]-A(1OMe, 1([@@]-Methylenedioxy))-B(1([@@]-Methylenedioxy)) | Flavonol | Meliternatin |
| 0.000 | [CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy)) | CCS-type derivative / [3,2']-Epoxymethanoflavone | 6-Methoxypulcherrimin |
| 0.000 | [Flavan 3,4-diol]-A(1OMe, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH) | Flavan 3,4-diol | 4beta-Hydroxyobovatachromene |
| 0.000 | [Flavan 3,4-diol]-A(2OMe, 1([2,3:@@]-Furano))-B(none) | Flavan 3,4-diol | 3,4,5,6-Tetramethoxyfurano[2,3-h]flavan |
| 0.000 | [Flavan 3,4-diol]-A(2OMe, 1([2,3:@@]-Furano))-B(none) | Flavan 3,4-diol | Diplotropin |
| 0.000 | [Isoflavone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(2OH) | Isoflavone | 2,3-Dehydrokievitol |
| 0.000 | [Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OH) | Isoflavone | Lunatone |
| 0.000 | [Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OH) | Isoflavone | Lupinisoflavone B |
| 0.000 | [Isoflavone]-A(2OH)-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano))) | Isoflavone | Lupinisoflavone D |
| 0.000 | [Isoflavan]-A(1OH)-B(1OH, 2OMe, 1(1,1-Dimethylallyl)) | Isoflavan | Unanisoflavan |
| 0.000 | [Pterocarpan-6a-ol]-A(1OH)-B(1OH, 1OMe, 1(C-Prenyl)) | Pterocarpan-6a-ol | Sphenostylin B |
| 0.000 | [6-Oxodehydrorotenone]-A(1OH, 1OMe)-B(2OMe) | 6-Oxodehydrorotenone | Stemonone |