ピーク情報
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きく 花びら 生 ピンク
pos
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| Peak #5426 MN MID: SE123_S060582_M90 |
| m/z: 378.22736, RT: 82.34, 強度: 56647, ログ強度: 1.31, アダクト: [M+CH5N+H]+, 共有数（同様のピークを含むサンプル数）: 2 |
| DB検索結果: (117 names) Thymifodioic acid;Maoecrystal C;Heteroplexisolide C;(+)-Heteroplexisolide C;Heteroplexisolide B;(+)-Heteroplexisolide B;Macrocalyxoformin A;Sculponeatin A;(-)-Sculponeatin A;Gaudichanolide B;(-)-Gaudi... |
| DBごとのヒット数: ALL 89 KG 6 KN 77 HM 6 |
| FlavonoidSearch最大スコア MS2: -, MS3: - |
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 |
|---|---|---|---|---|
| C20H26O5 | 346.17802 | -0.396 | Thymifodioic acid | KNApSAcK: C00022122 |
| C20H26O5 | 346.17802 | -0.396 | Maoecrystal C | KNApSAcK: C00051465 |
| C20H26O5 | 346.17802 | -0.396 | Heteroplexisolide C | KNApSAcK: C00047452 |
| C20H26O5 | 346.17802 | -0.396 | Heteroplexisolide B | KNApSAcK: C00047451 |
| C20H26O5 | 346.17802 | -0.396 | Gaudichanolide B | KNApSAcK: C00042176, C00042545 |
| C20H26O5 | 346.17802 | -0.396 | Macrocalyxoformin A | KNApSAcK: C00048102 |
| C20H26O5 | 346.17802 | -0.396 | Hanagokenol B | KNApSAcK: C00030454 |
| C20H26O5 | 346.17802 | -0.396 | Royleanonic acid | HMDB: HMDB0257320 |
| C20H26O5 | 346.17802 | -0.396 | Trixikingolide isovalerate | KNApSAcK: C00021744, C00021745 |
| C20H26O5 | 346.17802 | -0.396 | Isodocarpin | KNApSAcK: C00050907 |
| C20H26O5 | 346.17802 | -0.396 | 16-Hydroxycarnosol | KNApSAcK: C00031517 |
| C20H26O5 | 346.17802 | -0.396 | Methyl gibberellin A4 | HMDB: HMDB0254589 KEGG: C20633 |
| C20H26O5 | 346.17802 | -0.396 | Laxiflorin A | KNApSAcK: C00051214 |
| C20H26O5 | 346.17802 | -0.396 | 8alpha-Tigloxyartabsin | KNApSAcK: C00034401, C00034403 |
| C20H26O5 | 346.17802 | -0.396 | Angeloylcumambrin B | HMDB: HMDB0034605 KNApSAcK: C00020479 |
| C20H26O5 | 346.17802 | -0.396 | LL-S491beta | KNApSAcK: C00023996 |
| C20H26O5 | 346.17802 | -0.396 | Guidongnin B | KNApSAcK: C00044791 |
| C20H26O5 | 346.17802 | -0.396 | Chushizisin D | KNApSAcK: C00047411, C00047412 |
| C20H26O5 | 346.17802 | -0.396 | ,[1aR-[1aalpha,3alpha(Z),4beta,4abeta,5beta,9alphaS*]]-1a,2,4,4a,5,9-Hexahydro-5-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-butenoic acid | KNApSAcK: C00017377 |
| C20H26O5 | 346.17802 | -0.396 | Peregrinin | KNApSAcK: C00022266 |
| C20H26O5 | 346.17802 | -0.396 | Deacetylpseudolaric acid A | KNApSAcK: C00038950 |
| C20H26O5 | 346.17802 | -0.396 | Durumolide E | KNApSAcK: C00048698 |
| C20H26O5 | 346.17802 | -0.396 | Taiwaniaquinone B | KNApSAcK: C00032278, C00032279 |
| C20H26O5 | 346.17802 | -0.396 | Badkhysidin | KNApSAcK: C00013026 |
| C20H26O5 | 346.17802 | -0.396 | Laxiflorin L | KNApSAcK: C00051220 |
| C20H26O5 | 346.17802 | -0.396 | Isorosmanol | HMDB: HMDB0036661 KNApSAcK: C00037344 |
| C20H26O5 | 346.17802 | -0.396 | Microhelenin C | KEGG: C09509 KNApSAcK: C00003330, C00020963, C00021131 |
| C20H26O5 | 346.17802 | -0.396 | Xerophilusin B | KNApSAcK: C00040682 |
| C20H26O5 | 346.17802 | -0.396 | Epirosmanol | HMDB: HMDB0035812 KNApSAcK: C00030193 |
| C20H26O5 | 346.17802 | -0.396 | Gibberellin A64 | HMDB: HMDB0036894 KNApSAcK: C00000064 |
| C20H26O5 | 346.17802 | -0.396 | Verimol G | HMDB: HMDB0036474 |
| C20H26O5 | 346.17802 | -0.396 | [3R-(3alpha,3aalpha,4alpha,4abeta,7abeta,8alpha,9aalpha)]-2,3,3a,4,4a,7,7a,8,9,9a-Decahydro-3,5,8-trimethyl-2,7-dioxoazuleno[6,5-b]furan-4-yl ester 3-methyl-2-butenoic acid | KNApSAcK: C00020943 |
| C20H26O5 | 346.17802 | -0.396 | (2R,5R,8R,9S,10R)-2-oxo-cleroda-3,13-dien-16,15-olide-18-oic acid | LipidMAPS: LMPR0104040006 |
| C20H26O5 | 346.17802 | -0.396 | Xyloketal B | HMDB: HMDB0259942 |
| C20H26O5 | 346.17802 | -0.396 | Hydroxyperezone monoangelate | KNApSAcK: C00011662 |
| C20H26O5 | 346.17802 | -0.396 | Secochiliolide acid | KNApSAcK: C00022530 |
| C20H26O5 | 346.17802 | -0.396 | Eupaglehnin C | KNApSAcK: C00012191, C00032954 |
| C20H26O5 | 346.17802 | -0.396 | Miliusate | KNApSAcK: C00037505 |
| C20H26O5 | 346.17802 | -0.396 | Coleon U | KNApSAcK: C00034936 |
| C20H26O5 | 346.17802 | -0.396 | Gibberellin A37 | HMDB: HMDB0035047 KEGG: C14161 KNApSAcK: C00000037 |
| C20H26O5 | 346.17802 | -0.396 | 6-O-Senecioylplenolin | KNApSAcK: C00021126 |
| C20H26O5 | 346.17802 | -0.396 | Pestalotiopsone B | KNApSAcK: C00047534 |
| C20H26O5 | 346.17802 | -0.396 | 7'-O-Methylmarmin | HMDB: HMDB0040795 |
| C20H26O5 | 346.17802 | -0.396 | Debromohamigeran A | KNApSAcK: C00046714 |
| C20H26O5 | 346.17802 | -0.396 | 2alpha-Hydroxy-3alpha,4alpha,15,16-bisepoxy-8beta,10betaH-ent-cleroda-13(16),14-diene-20,12-olide | KNApSAcK: C00022540 |
| C20H26O5 | 346.17802 | -0.396 | Estafiatin 8-O-isovalerate | KNApSAcK: C00033836 |
| C20H26O5 | 346.17802 | -0.396 | Leonotinin | KNApSAcK: C00022217 |
| C20H26O5 | 346.17802 | -0.396 | 3alpha-Hydroxy-5beta,10beta-epoxychiliolide | KNApSAcK: C00022534 |
| C20H26O5 | 346.17802 | -0.396 | 17-Hydroxyjolkinolide B | KNApSAcK: C00038174 |
| C20H26O5 | 346.17802 | -0.396 | beta-Cyclotanacin | KNApSAcK: C00012867 |
| C20H26O5 | 346.17802 | -0.396 | beta-Perezol | KNApSAcK: C00021727, C00021728 |
| C20H26O5 | 346.17802 | -0.396 | Trichorabdal A | KNApSAcK: C00035769 |
| C20H26O5 | 346.17802 | -0.396 | Gibberellin A44 | HMDB: HMDB0036901 KEGG: C12308 KNApSAcK: C00000044 LipidMAPS: LMPR0104170030 |
| C20H26O5 | 346.17802 | -0.396 | 19-Noraldosterone | HMDB: HMDB0041795 |
| C20H26O5 | 346.17802 | -0.396 | Deltoidin A | KNApSAcK: C00012103 |
| C20H26O5 | 346.17802 | -0.396 | Pulchellin F | KNApSAcK: C00012874 |
| C20H26O5 | 346.17802 | -0.396 | Cyathin B5 | KNApSAcK: C00012360 |
| C20H26O5 | 346.17802 | -0.396 | Gelomulide J | KNApSAcK: C00042553 |
| C20H26O5 | 346.17802 | -0.396 | Cyathin C5 | KNApSAcK: C00023682 |
| C20H26O5 | 346.17802 | -0.396 | Bacrispine | KNApSAcK: C00050008 |
| C20H26O5 | 346.17802 | -0.396 | Myristargenol B | KNApSAcK: C00032046 |
| C20H26O5 | 346.17802 | -0.396 | 8alpha-Tigloyloxydouglanin | KNApSAcK: C00033593, C00033596 |
| C20H26O5 | 346.17802 | -0.396 | KNApSAcK: C00050691, C00050692 |
|
| C20H26O5 | 346.17802 | -0.396 | Gibberellin A113 | HMDB: HMDB0032819 KNApSAcK: C00001499, C00001505 |
| C20H26O5 | 346.17802 | -0.396 | 6beta-Hydroxy-incana-pteroniolide | KNApSAcK: C00022543 |
| C20H26O5 | 346.17802 | -0.396 | Hypoglicin D | KNApSAcK: C00055919 |
| C20H26O5 | 346.17802 | -0.396 | Arturin | KNApSAcK: C00012979, C00012983 |
| C20H26O5 | 346.17802 | -0.396 | Dracocephalone A | KNApSAcK: C00044727 |
| C20H26O5 | 346.17802 | -0.396 | Laxiflorin C | KNApSAcK: C00051216 |
| C20H26O5 | 346.17802 | -0.396 | Heteroplexisolide D | KNApSAcK: C00047453 |
| C20H26O5 | 346.17802 | -0.396 | [4S-[4alpha(E),4aalpha,5alpha,8beta,8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-8-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid | KNApSAcK: C00017309 |
| C20H26O5 | 346.17802 | -0.396 | Mollisorin A | KNApSAcK: C00011780 |
| C20H26O5 | 346.17802 | -0.396 | Marrubinone B | KNApSAcK: C00033162 |
| C20H26O5 | 346.17802 | -0.396 | Caesalmin G | KNApSAcK: C00042324 |
| C20H26O5 | 346.17802 | -0.396 | [4aS-[4aalpha,5alpha,6alpha(Z),8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a-dimethyl-6-[(2-methyl-1-oxo-2-butenyl)oxy]-naphtho[2,3-b]furan-5-carboxylic acid | KNApSAcK: C00017407 |
| C20H26O5 | 346.17802 | -0.396 | Royleanonic acid | KNApSAcK: C00035386 |
| C20H26O5 | 346.17802 | -0.396 | Gibberellin A24 | HMDB: HMDB0303459 KEGG: C11861 KNApSAcK: C00000024 LipidMAPS: LMPR0104170018 |
| C20H26O5 | 346.17802 | -0.396 | Inflexusin B | KNApSAcK: C00050836 |
| C20H26O5 | 346.17802 | -0.396 | Pyrrhopappolide | KNApSAcK: C00022544 |
| C20H26O5 | 346.17802 | -0.396 | Maoyecrystal J | KNApSAcK: C00041661 |
| C20H26O5 | 346.17802 | -0.396 | Nobilin | HMDB: HMDB0036690 KEGG: C09518 KNApSAcK: C00003339, C00011798 |
| C20H26O5 | 346.17802 | -0.396 | Cornutin E | KNApSAcK: C00036099 |
| C20H26O5 | 346.17802 | -0.396 | Longirabdacetal | KNApSAcK: C00051310 |
| C20H26O5 | 346.17802 | -0.396 | [4S-[4alpha(E),4aalpha,5beta,8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid | KNApSAcK: C00017311, C00017312 |
| C20H26O5 | 346.17802 | -0.396 | Ballotinone | KNApSAcK: C00022391 |
| C20H26O5 | 346.17802 | -0.396 | [1aR-[1aalpha,4beta,4abeta,5beta(Z),9aS*]]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 4-hydroxy-2-methyl-2-butenoic acid | KNApSAcK: C00017322 |
| C20H26O5 | 346.17802 | -0.396 | 1a,2,4,4a,5,9-Hexahydro-4-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methyl-2-butenoic acid | KNApSAcK: C00017388 |
| C20H26O5 | 346.17802 | -0.396 | 3-Oxo-6b-angeloyloxy-7(11)-eremophilen-12,8a-olide | HMDB: HMDB0032896 |
| C20H26O5 | 346.17802 | -0.396 | Maoyecrystal I | KNApSAcK: C00051480 |
| C20H26O5 | 346.17802 | -0.396 | Preperegrinin | KNApSAcK: C00023348, C00048251 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 378.22665 |
| Splash: splash10-004i-0090000000-7c0529fa975775b844df |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 229.05 | 20324 | 149 | 1000 |
| 211.01 | 8092 | 167 | 398 |
| 247.01 | 5038 | 131 | 247 |
| 183.03 | 2689 | 195 | 132 |
| 278.11 | 1422 | 100 | 69 |
| 201.11 | 1249 | 177 | 61 |
| 328.88 | 1108 | 49 | 54 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 229.04568 |
| Splash: splash10-03e9-0490000000-eeeade2e1e47e8a9227a |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 211.03 | 7476 | 18 | 1000 |
| 183.07 | 4388 | 46 | 586 |
| 201.11 | 1521 | 28 | 203 |
| 157.06 | 577 | 72 | 77 |
FlavonoidSearch結果
ヒットなし
| Level: 3, プリカーサーm/z: 211.01324 |
| Splash: splash10-001i-0900000000-7b96f8da0a9dd592838c |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 181.11 | 2718 | 30 | 1000 |
| 183.10 | 2149 | 28 | 790 |
| 193.12 | 1777 | 18 | 653 |
| 169.04 | 171 | 42 | 62 |
| 167.07 | 169 | 44 | 62 |
FlavonoidSearch結果
| Score | Symbolized Name | MSMS-Category | MSMS-Aglycone |
|---|---|---|---|
| 0.000 | [Dihydrochalcone]-A(none)-B(none) | Dihydrochalcone | Dihydrochalcone |
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 |
|---|