ピーク情報
|
ゼニゴケ Takaragaike-1
pos
|
| Peak #2831 MN MID: SE205_S05_M90 |
| m/z: 492.36852, RT: 102.29, 強度: 5156, ログ強度: 0.31, アダクト: [M+CH5N+H]+, 共有数（同様のピークを含むサンプル数）: 1 |
| DB検索結果: (12 names) Chaxine D;Stoloniferone G;(-)-Stoloniferone G;Polyporusterone D;Polyporusterone G;(3beta,5alpha,9alpha,14alpha,22E,24R)-3,5,9,14-Tetrahydroxyergosta-7,22-dien-6-one;Polyporusterone E;(5Z,7E,22E)-(1S,3... |
| DBごとのヒット数: ALL 11 KN 5 HM 1 LM 5 |
| FlavonoidSearch最大スコア MS2: -, MS3: 0.088 |
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 |
|---|---|---|---|---|
| C28H44O5 | 460.31887 | 0.369 | Chaxine D | KNApSAcK: C00054309 |
| C28H44O5 | 460.31887 | 0.369 | Stoloniferone G | KNApSAcK: C00046433 LipidMAPS: LMST01031094 |
| C28H44O5 | 460.31887 | 0.369 | Polyporusterone G | HMDB: HMDB0038501 KNApSAcK: C00043840 LipidMAPS: LMST01031303 |
| C28H44O5 | 460.31887 | 0.369 | Polyporusterone D | HMDB: HMDB0038500 KNApSAcK: C00043837 LipidMAPS: LMST01031300 |
| C28H44O5 | 460.31887 | 0.369 | (3beta,5alpha,9alpha,14alpha,22E,24R)-3,5,9,14-Tetrahydroxyergosta-7,22-dien-6-one | HMDB: HMDB0032690 LipidMAPS: LMST01031332 |
| C28H44O5 | 460.31887 | 0.369 | Polyporusterone E | HMDB: HMDB0038498 KNApSAcK: C00043838 LipidMAPS: LMST01031301 |
| C28H44O5 | 460.31887 | 0.369 | (5Z,7E,22E)-(1S,3R,24R,25)-9,10-seco-5,7,10(19),22-ergostatetraene-1,3,24,25,26-pentol | LipidMAPS: LMST03010054 |
| C28H44O5 | 460.31887 | 0.369 | (22S,23R)-5alpha,6alpha-epoxy-3beta,7beta,23-trihydroxy-15(14-22)-abeo-ergost-8-en-14-one | LipidMAPS: LMST01031188, LMST01031189 |
| C28H44O5 | 460.31887 | 0.369 | 3beta,6alpha-dihydroxy-11-acetoxy-24-nor-9,11-seco-cholest-7,22E-diene-9-one | LipidMAPS: LMST03020680 |
| C28H44O5 | 460.31887 | 0.369 | (5Z,7E,22E)-(1S,3R)-9,10-seco-5,7,10(19),22-ergostatetraene-1,3,24,25,28-pentol | LipidMAPS: LMST03010055 |
| C28H44O5 | 460.31887 | 0.369 | ergosta-7,9(11),22E-trien-3beta,5alpha,6beta,14alpha,25-pentol | LipidMAPS: LMST01031157 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 492.36783 |
| Splash: splash10-03xr-0006900000-e0567739181d3c71e067 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 461.02 | 1143 | 31 | 1000 |
| 317.31 | 632 | 175 | 553 |
| 335.17 | 248 | 157 | 216 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 317.31351 |
| Splash: splash10-00dj-0910000000-77366bbc6c31051db5dc |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 173.08 | 72 | 144 | 1000 |
| 145.09 | 24 | 172 | 336 |
| 147.06 | 23 | 170 | 313 |
| 159.06 | 20 | 158 | 283 |
| 120.97 | 19 | 196 | 266 |
| 191.01 | 19 | 126 | 259 |
| 186.97 | 17 | 130 | 236 |
| 106.98 | 11 | 210 | 155 |
| 233.19 | 11 | 84 | 150 |
| 229.29 | 9 | 88 | 123 |
| 243.25 | 8 | 74 | 114 |
| 153.12 | 8 | 164 | 108 |
| 200.96 | 7 | 116 | 101 |
| 165.11 | 6 | 152 | 86 |
| 133.04 | 6 | 184 | 79 |
| 175.23 | 6 | 142 | 78 |
| 96.81 | 5 | 220 | 72 |
| 239.02 | 5 | 78 | 64 |
| 135.01 | 4 | 182 | 59 |
| 94.81 | 4 | 223 | 54 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.133 | [Flavonol]-A(2OH)-B(1OH, 1OMe) | Flavonol | 3'-O-Methylmelanoxetin |
| 0.133 | [Flavonol]-A(2OH)-B(1OH, 1OMe) | Flavonol | Isorhamnetin |
| 0.133 | [Flavonol]-A(2OH)-B(1OH, 1OMe) | Flavonol | Tamarixetin |
| 0.133 | [Flavonol]-A(2OH)-B(1OH, 1OMe) | Flavonol | Milimorin |
| 0.121 | [Isoflavone]-A(2OH)-B(2OH, 1OMe) | Isoflavone | Junipegenin A |
| 0.121 | [Isoflavone]-A(3OH, 1OMe)-B(1OH) | Isoflavone | 5,6,7,4'-Tetrahydroxy-8-methoxyisoflavone |
| 0.121 | [Isoflavone]-A(3OH)-B(1OH, 1OMe) | Isoflavone | 5,6,7,4'-Tetrahydroxy-3'-methoxyisoflavone |
| 0.107 | [Flavanone]-A(2OH)-B(2OMe) | Flavanone | Eriodictyol 3',4'-dimethyl ether |
| 0.107 | [Flavanone]-A(1OH, 2OMe)-B(1OH) | Flavanone | 5,4'-Dihydroxy-6,7-dimethoxyflavanone |
| 0.107 | [Flavanone]-A(1OH, 2OMe)-B(1OH) | Flavanone | Dihydroskullcap flavone I |
| 0.107 | [Flavanone]-A(1OH, 2OMe)-B(1OH) | Flavanone | 5,4'-Dihydroxy-7,8-dimethoxyflavanone |
| 0.103 | [Anthocyanidin]-A(2OH)-B(2OH, 1OMe) | Anthocyanidin | Petunidin |
| 0.103 | [Anthocyanidin]-A(1OH, 1OMe)-B(3OH) | Anthocyanidin | Pulchellidin |
| 0.097 | [Flavonol]-A(1OH, 1OMe)-B(2OH) | Flavonol | 7-Methoxy-3,6,3',4'-tetrahydroxyflavone |
| 0.097 | [Flavonol]-A(1OH, 1OMe)-B(2OH) | Flavonol | 3,7,3',4'-Tetrahydroxy-8-methoxyflavone |
| 0.097 | [Flavonol]-A(1OH, 1OMe)-B(2OH) | Flavonol | Azaleatin |
| 0.097 | [Flavonol]-A(1OH, 1OMe)-B(2OH) | Flavonol | Rhamnetin |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | Vogeletin |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | 6-Methoxykaempferol |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | 3,5,6,4'-Tetrahydroxy-7-methoxyflavone |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | 3,5,8,2'-Tetrahydroxy-7-methoxyflavone |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | Pollenitin |
| 0.097 | [Flavonol]-A(2OH, 1OMe)-B(1OH) | Flavonol | Sexangularetin |
| 0.097 | [Flavonol]-A(3OH)-B(1OMe) | Flavonol | 3,5,6,7-Tetrahydroxy-4'-methoxyflavone |
| 0.097 | [Flavonol]-A(3OH)-B(1OMe) | Flavonol | Herbacetin 4'-methyl ether |
| 0.074 | [2'-Hydroxychalcone]-A(3OH)-B(2OMe) | 2'-Hydroxychalcone | Okanin 3,4-dimethyl ether |
| 0.040 | [Pterocarpan]-A(1OH)-B(1OH, 2OMe) | Pterocarpan | Philenopteran |
| 0.036 | [2'-Hydroxychalcone]-A(3OH, 2OMe)-B(none) | 2'-Hydroxychalcone | 3',4',6'-Trihydroxy-2',5'-dimethoxychalcone |
| 0.036 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(1OH, 1OMe) | 2'-Hydroxychalcone | 2',4',4-Trihydroxy-3',3-methoxychalcone |
| 0.036 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(1OH, 1OMe) | 2'-Hydroxychalcone | 3,4',6'-Trihydroxy-4,2'-dimethoxychalcone |
| 0.036 | [2'-Hydroxychalcone]-A(2OH, 1OMe)-B(1OH, 1OMe) | 2'-Hydroxychalcone | 4,2',6'-Trihydroxy-3,4'-dimethoxychalcone |
| 0.033 | [Flavanone]-A(2OH, 2OMe)-B(none) | Flavanone | Didymocarpin A |
| 0.033 | [Flavanone]-A(2OH, 1OMe)-B(1OMe) | Flavanone | 7,8-Dihydroxy-6,4'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(2OH, 1OMe)-B(1OMe) | Flavanone | 5,7-Dihydroxy-8,2'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(2OH, 1OMe)-B(1OMe) | Flavanone | 5,7-Dihydroxy-8,4'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | 7,4'-Dihydroxy-8,3'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-7,5'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | 5,3'-Dihydroxy-7,2'-dimethoxyflavanone |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | Eriodictyol 5,4'-dimethyl ether |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | Eriodictyol 7,3'-dimethyl ether |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | Persicogenin |
| 0.033 | [Flavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Flavanone | 5,2'-Dihydroxy-7,4'-dimethoxyflavanone |
| 0.000 | [Flavone]-A(2OH)-B(2OH, 1OMe) | Flavone | Tricetin 3'-methyl ether |
| 0.000 | [Flavone]-A(2OH)-B(2OH, 1OMe) | Flavone | Tricetin 4'-methyl ether |
| 0.000 | [Flavone]-A(1OH, 1OMe)-B(3OH) | Flavone | Tricetin 7-methyl ether |
| 0.000 | [Flavone]-A(3OH)-B(1OH, 1OMe) | Flavone | Nodifloretin |
| 0.000 | [Flavone]-A(3OH)-B(1OH, 1OMe) | Flavone | 6-Hydroxyluteolin 4'-methyl ether |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH) | Flavone | Carajuflavone |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH) | Flavone | Nepetin |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH) | Flavone | Pedalitin |
| 0.000 | [Flavone]-A(3OH)-B(1OH, 1OMe) | Flavone | Hypolaetin 3'-methyl ether |
| 0.000 | [Flavone]-A(3OH)-B(1OH, 1OMe) | Flavone | Hypolaetin 4'-methyl ether |
| 0.000 | [Flavone]-A(2OH, 1OMe)-B(2OH) | Flavone | Onopordin |
| 0.000 | [Dihydroflavonol (3-OMe)]-A(1OMe)-B(2OH) | Dihydroflavonol | Fustin 3,7-dimethyl ether |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe)-B(1OMe) | Dihydroflavonol | Aromadendrin 7,4'-dimethyl ether |
| 0.000 | [Dihydroflavonol]-A(2OMe)-B(1OH) | Dihydroflavonol | Aromadendrin 5,7-dimethyl ether |
| 0.000 | [Dihydrochalcone]-A(1OH, 2OMe)-B(1OMe) | Dihydrochalcone | Flavokawin A |
| 0.000 | [Dihydrochalcone]-A(none)-B(1OH, 3OMe) | Dihydrochalcone | 2-Hydroxy-3,4,6-trimethoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(none)-B(1OH, 3OMe) | Dihydrochalcone | 2-Hydroxy-4,5,6-trimethoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(3OMe)-B(1OH) | Dihydrochalcone | 4-Hydroxy-2',4',6'-trimethoxydihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(1OH)-B(3OMe) | Dihydrochalcone | Loureirin B |
| 0.000 | [Dihydrochalcone]-A(1OH, 3OMe)-B(none) | Dihydrochalcone | 2'-Hydroxy-3',4',6'-trimethoxydihydrochalcone |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1OMe) | Pterocarpan | 2,8-Dihydroxy-3,9-dimethoxypterocarpan |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1OMe) | Pterocarpan | Mucronucarpan |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1OMe) | Pterocarpan | Nissolicarpin |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1OMe) | Pterocarpan | Melilotocarpan D |
| 0.000 | [Pterocarpan]-A(1OH, 1OMe)-B(1OH, 1OMe) | Pterocarpan | Melilotocarpan E |
| 0.000 | [Isoflavanone]-A(1OH)-B(1OH, 2OMe) | Isoflavanone | 7,4'-Dihydroxy-3',5'-dimethoxyisoflavanone |
| 0.000 | [Isoflavanone]-A(1OH)-B(1OH, 2OMe) | Isoflavanone | Violanone |
| 0.000 | [Isoflavanone]-A(1OH)-B(1OH, 2OMe) | Isoflavanone | Lespedeol C |
| 0.000 | [Isoflavanone]-A(2OH)-B(2OMe) | Isoflavanone | Homoferreirin |
| 0.000 | [Isoflavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Isoflavanone | Cajanol |
| 0.000 | [Isoflavanone]-A(1OH, 1OMe)-B(1OH, 1OMe) | Isoflavanone | 7,4'-Dihydroxy-5,2'-dimethoxyisoflavanone |
| 0.000 | [Aurone]-A(1OH, 1OMe)-B(3OH) | Aurone | Bracteatin 4-Methyl ether |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe, 2Methyl)-B(1OH) | Dihydrochalcone | 4,2',6'-Trihydroxy-4'-methoxy-3',5'-dimethyldihydrochalcone |
| 0.000 | [Dihydrochalcone]-A(2OH, 1OMe)-B(1([@@]-Methylenedioxy)) | Dihydrochalcone | 2',4'-Dihydroxy-6'-methoxy-3,4-methylenedioxydihydrochalcone |
| 0.000 | [Dihydrochalcone alpha-ol]-A(2OMe)-B(1OMe) | Dihydrochalcone alpha-ol | O-Methylodoratol |
| 0.000 | [Flavanone]-A(1OH, 1OMe, 1Methyl)-B(2OH) | Flavanone | 7,3',4'-Trihydroxy-5-methoxy-6-C-methylflavanone |
| 0.000 | [Flavanone]-A(2OH, 2Methyl)-B(2OH) | Flavanone | Cyrtominetin |
| 0.000 | [Flavanone]-A(1OH, 1([@@]-Methylenedioxy))-B(2OH) | Flavanone | 5,2',3'-Trihydroxy-6,7-methylenedioxyflavanone |
| 0.000 | [2-Hydroxyflavanone]-A(1OH, 2OMe, 1Methyl)-B(none) | 2-Hydroxyflavanone | Mosloflavanone |
| 0.000 | [Dihydroflavonol]-A(2OH, 1Methyl)-B(1OMe) | Dihydroflavonol | 3,5,7-Trihydroxy-4'-methoxy-6-methylflavanone |
| 0.000 | [Dihydroflavonol]-A(1OH, 1OMe, 1Methyl)-B(1OH) | Dihydroflavonol | 3,7,4'-Trihydroxy-5-methoxy-6-methylflavanone |
| 0.000 | [CCS-type derivative / [3,2']-Epoxymethanodihydroflavanone]-A(2OH)-B(2OH) | CCS-type derivative / [3,2']-Epoxymethanodihydroflavanone | Crombeone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH) | Flavonol | 3-Methoxy-6,7,3',4'-tetrahydroxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH) | Flavonol | Transilitin |
| 0.000 | [Flavonol (3-OMe)]-A(2OH)-B(2OH) | Flavonol | Quercetin 3-methyl ether |
| 0.000 | [Flavonol]-A(2OH, 1Methyl)-B(2OH) | Flavonol | Pinoquercetin |
| 0.000 | [Flavonol]-A(2OH, 1Methyl)-B(2OH) | Flavonol | 8-C-Methylquercetin |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH) | Flavonol | 5,6,7,4'-Tetrahydroxy-3-methoxyflavone |
| 0.000 | [Flavonol (3-OMe)]-A(3OH)-B(1OH) | Flavonol | 3-Methylherbacetin |
| 0.000 | [Flavan 4-ol]-A(2OMe)-B(1OMe) | Flavan 4-ol | 4-Hydroxy-5,7,4'-trimethoxyflavan |
| 0.000 | [Flavan 4-ol]-A(2OH, 2Methyl)-B(1OMe) | Flavan 4-ol | 4,5,7-Trihydroxy-4'-methoxy-6,8-dimethylflavan |
| 0.000 | [CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol]-A(1OMe)-B(2OH) | CCS-type derivative / [3,2']-Epoxymethanoflavan 4-ol | 7-O-Methylpeltogynol |
| 0.000 | [Flavan]-A(1OH, 1OMe)-B(2OMe) | Flavan | 2-(3,5-Dimethoxyphenyl)-3,4-dihydro-7-methoxy-2H-1-benzopyran-5-ol |
| 0.000 | [Flavan]-A(1OH, 1OMe)-B(2OMe) | Flavan | 5-Hydroxy-7,3',4'-trimethoxyflavan |
| 0.000 | [Flavan]-A(2OMe)-B(1OH, 1OMe) | Flavan | 4'-Hydroxy-5,7,3'-trimethoxyflavan |
| 0.000 | [Isoflavanone]-A(1OH, 1OMe, 1Methyl)-B(2OH) | Isoflavanone | Ougenin |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(1OH)-B(2OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Pendulone |
| 0.000 | [UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan]-A(1OH, 1OMe)-B(1OMe) | UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavan | Mucroquinone |
| 0.000 | [isoflavan-4-ol]-A(1OH, 1OMe, 1([@@]-Methylenedioxy))-B(none) | isoflavan-4-ol | Lapathinol |
| 0.000 | [isoflavene]-A(2OH)-B(1OH, 2OMe) | isoflavene | 6,7,3'-Trihydroxy-2',4'-dimethoxyisoflavene |
| 0.000 | [Pterocarpan-6a-ol]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy)) | Pterocarpan-6a-ol | 6a,7-Dihydroxymaackiain |
| 0.000 | [12a-Hydroxyrotenone]-A(2OH)-B(1OH) | 12a-Hydroxyrotenone | 4,9,11,12a-Tetrahydroxyrotenoid |
| 0.000 | [4-phenylcoumarin]-A(1OH, 1OMe)-B(3OH) | 4-phenylcoumarin | 5,2',4',5'-Tetrahydroxy-7-methoxy-4-phenylcoumarin |
| 0.000 | [Dalbergiquinol]-A(1OH, 3OMe)-B(1OH) | Dalbergiquinol | Kuhlmanniquinol |
| Level: 3, プリカーサーm/z: 461.01620 |
| Splash: splash10-014i-0009000000-87388074dddfdd1e1ce6 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 317.28 | 35 | 144 | 1000 |
| 334.65 | 5 | 126 | 149 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH, 2(C-Prenyl)) | 2'-Hydroxychalcone | Sophoradin |
| 0.000 | [Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH, 2(C-Prenyl)) | Flavanone | Sophoranone |
| 0.000 | [Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(1OMe) | Flavone | Isoembigenin |
| 0.000 | [Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(1OMe) | Flavone | Embigenin |
| 0.000 | [UBR-type derivative / 2',4'-Dioxo-5'-enyl-0-hydroxy-type Chalcone]-A(3(C-Prenyl))-B(1OH) | UBR-type derivative / 2',4'-Dioxo-5'-enyl-0-hydroxy-type Chalcone | Munchiwarin |
| 0.000 | [Flavan]-A(1OH, 1(1,1-Dimethylallyl))-B(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano))) | Flavan | Kazinol H |
関連ピーク情報
| ピーク番号 | 保持時間 (min) | m/z | m/z差分 | ログ強度 | アダクト | DB検索結果 | ヒット数 | MSn | FS2 | FS3 | N原子数 | S原子数 | 共有数 |
|---|