ピーク情報
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パセリ 葉
pos
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| Peak #10132 MN MID: SE61_S21_M90 |
| m/z: 689.38777, RT: 92.03, 強度: 12011, ログ強度: 0.49, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 3 |
| DB検索結果: (14 names) Lucyoside R;Quercilicoside A;Chebuloside II;Cyclopassifloside VI;Quadranoside III;(+)-Quadranoside III;Lucyoside R;Sericoside;Bellericoside;(+)-Bellericoside;Quadranoside II;(+)-Quadranoside II;3-O-be... |
| DBごとのヒット数: ALL 10 KN 9 HM 1 |
| FlavonoidSearch最大スコア MS2: -, MS3: 0.160 |
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 |
|---|---|---|---|---|
| C36H58O11 | 666.39791 | 0.954 | Lucyoside R | KNApSAcK: C00051340 |
| C36H58O11 | 666.39791 | 0.954 | Niga-ichigoside F1 | HMDB: HMDB0035691 KNApSAcK: C00031544, C00048019 |
| C36H58O11 | 666.39791 | 0.954 | Cyclopassifloside VI | HMDB: HMDB0035949 KNApSAcK: C00046702 |
| C36H58O11 | 666.39791 | 0.954 | Chebuloside II | KNApSAcK: C00032809 |
| C36H58O11 | 666.39791 | 0.954 | Lucyoside R | HMDB: HMDB0032836 |
| C36H58O11 | 666.39791 | 0.954 | Quadranoside III | KNApSAcK: C00040129 |
| C36H58O11 | 666.39791 | 0.954 | Sericoside | HMDB: HMDB0034504 KNApSAcK: C00035052, C00035163 |
| C36H58O11 | 666.39791 | 0.954 | Bellericoside | KNApSAcK: C00035058 |
| C36H58O11 | 666.39791 | 0.954 | 3-O-beta-Glucopyranosyl protobassic acid | KNApSAcK: C00046583 |
| C36H58O11 | 666.39791 | 0.954 | Quadranoside II | KNApSAcK: C00046340 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 689.38770 |
| Splash: splash10-0006-0000900000-03632607e95b1e1715b1 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 491.38 | 11173 | 198 | 1000 |
| 439.29 | 2520 | 250 | 225 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 491.35388 |
| Splash: splash10-0006-0191200000-b549e1105741ac283c18 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 243.06 | 65 | 248 | 1000 |
| 241.23 | 30 | 250 | 463 |
| 435.29 | 22 | 56 | 333 |
| 184.92 | 16 | 306 | 250 |
| 259.25 | 14 | 232 | 217 |
| 329.40 | 12 | 162 | 179 |
| 203.13 | 9 | 288 | 133 |
| 142.94 | 8 | 348 | 127 |
| 383.37 | 7 | 108 | 107 |
| 447.41 | 5 | 44 | 70 |
| 313.49 | 4 | 178 | 60 |
| 473.24 | 3 | 18 | 51 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.160 | [Isoflavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Isoflavone | Euchrenone b2 |
| 0.120 | [Flavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Flavone | Dorsilurin A |
| 0.000 | [Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OMe) | Flavone | Isoorientin 7,3',4'-trimethyl ether |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 1(1-(2-Hydroxy-5-methoxycarbonylphenyl)-3-methylbut-2-enyl))-B(none) | Dihydrochalcone | Piperaduncin A |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl), 1(6-Ethyl-4-hydroxy-5-methyl-2-oxo-2H-pyran-3-yl))-B(none) | Flavanone | 8-Prenyllepidissipyrone |
| 0.000 | [Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano))) | Flavanone | Amorinin |
| 0.000 | [Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1(C-Prenyl)) | Flavanone | Amoridin |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano))) | Flavanone | Tanariflavanone B |
| 0.000 | [Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano))) | Flavanone | Euchrenone a6 |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Flavone | Isoorientin 2''-O-acetate |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Flavone | Isoorientin 6''-O-acetate |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Flavone | Orientin 2''-O-acetate |
| 0.000 | [Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Flavone | Orientin 6''-O-acetate |
| 0.000 | [3-substituted Flavone (3-C-Prenyl)]-A(2OH, 2(C-Prenyl))-B(2OH) | 3-substituted Flavone | Artelasticin |
| 0.000 | [3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH) | 3-substituted Flavone | Rubraflavone C |
| 0.000 | [3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH) | 3-substituted Flavone | Artocommunol CD |
| 0.000 | [Flavone]-A(2OH, 1Farnesyl)-B(2OH) | Flavone | Moralbanone |
| 0.000 | [UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone ([2,3:4,3]-(6,6-Dimethyldihydropyrano))]-A(2([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH) | UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone | Dorsilurin E |
| 0.000 | [Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Isoflavone | Orobol 6-C-(6''-acetylglucoside) |
| 0.000 | [Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH) | Isoflavone | Orobol 8-C-(6''-acetylglucoside) |
| Level: 3, プリカーサーm/z: 439.30396 |
| Splash: splash10-0006-0094000000-31cb5e536195e035a16b |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 241.06 | 33 | 198 | 1000 |
| 349.27 | 14 | 90 | 436 |
| 369.04 | 13 | 70 | 403 |
| 242.98 | 12 | 196 | 360 |
| 277.11 | 8 | 162 | 246 |
| 383.49 | 7 | 56 | 225 |
| 261.41 | 4 | 178 | 122 |
| 221.28 | 4 | 218 | 108 |
| 203.05 | 3 | 236 | 98 |
| 185.11 | 3 | 254 | 91 |
| 259.27 | 3 | 180 | 80 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.214 | [Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Flavonol | Broussonol E |
| 0.214 | [Flavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Flavonol | Broussonol D |
| 0.190 | [Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl)) | Isoflavanone | Isosophoranone |
| 0.190 | [Isoflavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl)) | Isoflavanone | Sophoraisoflavanone B |
| 0.136 | [2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl)) | 2'-Hydroxychalcone | Antiarone D |
| 0.136 | [2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(C-Prenyl)) | 2'-Hydroxychalcone | Antiarone C |
| 0.130 | [Flavanone]-A(1OH, 1OMe, 1(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Flavanone | Maackiaflavanone |
| 0.087 | [2'-Hydroxychalcone]-A(3OH)-B(1OH, 1OMe, 2(C-Prenyl)) | 2'-Hydroxychalcone | Antiarone E |
| 0.083 | [Flavanone]-A(1OH, 1OMe, 2(C-Prenyl))-B(2OH) | Flavanone | Amoradicin |
| 0.083 | [Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe) | Flavanone | Hiravanone |
| 0.083 | [Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1OMe) | Flavanone | Flemiflavanone A |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe, 1Geranyl)-B(2OH) | 2'-Hydroxychalcone | Homoflemingin |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe, 1Geranyl)-B(2OH) | 2'-Hydroxychalcone | Flemiwallichin C |
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1OMe, 1Lavandulyl)-B(2OH) | 2'-Hydroxychalcone | Kuraridin |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(2OH) | Flavanone | Exiguaflavanone B |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(2OH) | Flavanone | Exiguaflavanone F |
| 0.000 | [Flavanone]-A(2OH)-B(1OMe, 1(C-Prenyl), 1(3-Hydroxy-3-methyl-1-butenyl)) | Flavanone | Burttinone |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)), 1(1-Hydroxy-3-methyl-2,3-epoxybutyl))-B(1OH) | Flavanone | 1'''-Hydroxy-2''',3'''-Epoxylupinifolin |
| 0.000 | [Flavanone]-A(2OH, 1Geranyl)-B(1OH, 1OMe) | Flavanone | 4'-O-Methyldiplacone |
| 0.000 | [Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1OMe, 1(1,1-Dimethylallyl)) | Flavanone | 5,7,4'-Trihydroxy-2'-methoxy-8-prenyl-5'-(1,1-dimethylallyl)flavanone |
| 0.000 | [Flavanone]-A(2OH, 1Lavandulyl)-B(1OH, 1OMe) | Flavanone | Isokurarinone |
| 0.000 | [Flavanone]-A(2OH, 1Lavandulyl)-B(1OH, 1OMe) | Flavanone | Leachianone A |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1Lavandulyl)-B(2OH) | Flavanone | Kurarinone |
| 0.000 | [Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-prenyl-4,5-dihydropyrano)))-B(1OH, 1OMe) | Flavanone | Leachianone B |
| 0.000 | [Flavone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH, 1(2-hydroxy-3-methyl-3-butenyl)) | Flavone | 6,3'-(2-hydroxy-3-methyl-3-butenyl)apigenin |
| 0.000 | [3-substituted Flavone (3-(3-Hydroxy-3-methylbutyl))]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH) | 3-substituted Flavone | Morusinol |
| 0.000 | [3-substituted Flavone (3-(3-Hydroxy-3-methylbutyl))]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH) | 3-substituted Flavone | Morusignin L |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe, 1Geranyl)-B(1OH) | Dihydroflavonol | Bonanniol B |
| 0.000 | [Dihydroflavonol]-A(2OH)-B(1OH, 1(5-Carboxy-2-hydroxyphenyl)) | Dihydroflavonol | Hypnum acid methyl este |
| 0.000 | [Flavonol]-A(1OH, 1([2,3:@@]-(4,4,5-Trimethyldihydrofurano)))-B(2OH, 1(C-Prenyl)) | Flavonol | Broussonol C |
| 0.000 | [Flavonol]-A(2OH, 1Lavandulyl)-B(2OH) | Flavonol | Kushenol C |
| 0.000 | [Isoflavone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(2OH, 1(C-Prenyl)) | Isoflavone | Lupinisol B |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Prenyl))-B(2OH, 1(2-hydroxy-3-methyl-3-butenyl)) | Isoflavone | Lupinisol C |
| 0.000 | [Isoflavone]-A(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano)))-B(2OH, 1(C-Prenyl)) | Isoflavone | Lupinisoflavone H |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano))) | Isoflavone | Lupinisoflavone I |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(5-(Hydroxyisopropanyl)dihydrofurano))) | Isoflavone | Lupinisoflavone J |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano))) | Isoflavone | Lupinisolone B |
| 0.000 | [Isoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano))) | Isoflavone | Lupinisolone C |
| 0.000 | [Isoflavan]-A(2OMe, 1(C-Prenyl))-B(2OH, 1(C-Prenyl)) | Isoflavan | Licorisoflavan A |
| 0.000 | [6-Hydroxydehydrorotenone (3-OMe)]-A(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))-B(2OMe) | 6-Hydroxydehydrorotenone | Villinol |