ピーク情報
|
イチョウ 葉
neg
|
| Peak #11583 MN MID: SE205_S01_M91 |
| m/z: 405.26507, RT: 91.39, 強度: 143141, ログ強度: 1.60, アダクト: [M-H]-, 共有数（同様のピークを含むサンプル数）: 1 |
| DB検索結果: (39 names) 2beta,3beta-Dihydroxy-6-oxo-5alpha-cholan-24-oic Acid;3beta,7alpha,12alpha-Trihydroxychol-5-en-24-oic Acid;3alpha,12alpha,15beta-Trihydroxy-5beta-chol-8(14)-en-24-oic Acid;7-Ketodeoxycholic acid;18-Is... |
| DBごとのヒット数: ALL 37 KG 3 KN 14 HM 2 LM 18 |
| 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 |
|---|---|---|---|---|
| C24H38O5 | 406.27192 | 1.032 | 2beta,3beta-Dihydroxy-6-oxo-5alpha-cholan-24-oic Acid | LipidMAPS: LMST04010172 |
| C24H38O5 | 406.27192 | 1.032 | 3beta,7alpha,12alpha-Trihydroxychol-5-en-24-oic Acid | LipidMAPS: LMST04010227 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,12alpha,15beta-Trihydroxy-5beta-chol-8(14)-en-24-oic Acid | LipidMAPS: LMST04010358 |
| C24H38O5 | 406.27192 | 1.032 | 7-Oxodeoxycholate | HMDB: HMDB0000391 KEGG: C04643 LipidMAPS: LMST04010184, LMST04010185, LMST04010186, LMST04010187 |
| C24H38O5 | 406.27192 | 1.032 | 18-Isobutyloxygrindelic acid | KNApSAcK: C00022633 |
| C24H38O5 | 406.27192 | 1.032 | Isolinaritriol 15,16-diacetate | KNApSAcK: C00023492 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,12beta-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010188, LMST04010374 |
| C24H38O5 | 406.27192 | 1.032 | Isolinaritriol 12,15-diacetate | KNApSAcK: C00023491 |
| C24H38O5 | 406.27192 | 1.032 | Dihydromonacolin MV | KNApSAcK: C00054416 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha-Dihydroxy-6-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010174, LMST04010175 |
| C24H38O5 | 406.27192 | 1.032 | Ardisianone | KEGG: C10298 KNApSAcK: C00002793 LipidMAPS: LMPK15050004 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010354 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,12alpha-Dihydroxy-15-oxo-5beta,14beta-cholan-24-oic Acid | LipidMAPS: LMST04010189 |
| C24H38O5 | 406.27192 | 1.032 | 5,9-Diacetoxygeranyllinalol | KNApSAcK: C00022083 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate | HMDB: HMDB0000400 KEGG: C01292 LipidMAPS: LMST04010176, LMST04010177, LMST04010178, LMST04010179, LMST04010180, LMST04010181, LMST04010182, LMST04010183 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha,12alpha-Trihydroxy-5alpha-chol-22-en-24-oic acid | LipidMAPS: LMST04010232, LMST04010307 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,6alpha-Dihydroxy-7-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010173 |
| C24H38O5 | 406.27192 | 1.032 | (6b,7b,13R)-6,7-Diacetoxy-8,14-labdadiene-13-ol | HMDB: HMDB0035288 |
| C24H38O5 | 406.27192 | 1.032 | Alfaprostolum | HMDB: HMDB0248132 |
| C24H38O5 | 406.27192 | 1.032 | 15,16-Diacetoxycarterochaetol | KNApSAcK: C00022337 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha-Dihydroxy-22-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010439 |
| C24H38O5 | 406.27192 | 1.032 | Annocherin A | HMDB: HMDB0033399 KNApSAcK: C00054665 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,7alpha,12beta-Trihydroxy-5beta-chol-9(11)-en-24-oic Acid | LipidMAPS: LMST04010402, LMST04010403 |
| C24H38O5 | 406.27192 | 1.032 | Vitetrifolin D | KNApSAcK: C00033484 |
| C24H38O5 | 406.27192 | 1.032 | Dihydromevinolin | KNApSAcK: C00018332 |
| C24H38O5 | 406.27192 | 1.032 | 6beta,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010272, LMST04010273 |
| C24H38O5 | 406.27192 | 1.032 | 3-Oxocholic acid | HMDB: HMDB0000502, [-1]HMDB0304121 LipidMAPS: LMST04010191, LMST04010443 |
| C24H38O5 | 406.27192 | 1.032 | (22E)-3alpha,6beta,7beta-Trihydroxy-5beta-chol-22-en-24-oic Acid | LipidMAPS: LMST04010231 |
| C24H38O5 | 406.27192 | 1.032 | 3beta,9alpha-Dihydroxy-11-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010291, LMST04010292 |
| C24H38O5 | 406.27192 | 1.032 | 10,18-Diacetoxy-8-hydroxy-2,6-dolabelladiene | KNApSAcK: C00050506 |
| C24H38O5 | 406.27192 | 1.032 | 6alpha,7alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010145 |
| C24H38O5 | 406.27192 | 1.032 | Varodiol diacetate | KNApSAcK: C00022347 |
| C24H38O5 | 406.27192 | 1.032 | Isolinaritriol 12,16-diacetate | KNApSAcK: C00023490 |
| C24H38O5 | 406.27192 | 1.032 | Diacarperoxide E | KNApSAcK: C00039006, C00039007 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,6beta-Dihydroxy-12-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010422, LMST04010423 |
| C24H38O5 | 406.27192 | 1.032 | 17-Isobutyloxygrindelic acid | KNApSAcK: C00022637 |
| C24H38O5 | 406.27192 | 1.032 | 3alpha,11beta-Dihydroxy-12-oxo-5beta-cholan-24-oic Acid | LipidMAPS: LMST04010337, LMST04010338 |
MSnスペクトル情報
| Level: 2, プリカーサーm/z: 405.26492 |
| Splash: splash10-01po-0069000000-4614c86a32d6a5677961 |
| m/z | Int. | NL | Rel.Int. |
|---|---|---|---|
| 231.16 | 9675 | 174 | 1000 |
| 343.35 | 9179 | 62 | 948 |
| 361.31 | 6650 | 44 | 687 |
| 325.34 | 3810 | 80 | 393 |
| 249.18 | 2056 | 156 | 212 |
| 243.19 | 1514 | 162 | 156 |
| 219.06 | 1127 | 186 | 116 |
| 275.22 | 822 | 130 | 85 |
| 359.38 | 787 | 46 | 81 |
| 341.39 | 599 | 64 | 61 |
| 245.33 | 583 | 160 | 60 |
| 261.36 | 564 | 144 | 58 |
FlavonoidSearch結果
ヒットなし