ピーク情報

タバコBY-2細胞　3日目

pos

Peak #1517 MN MID: SE204_S03_M90

m/z: 762.26836, RT: 37.86, 強度: 2452, ログ強度: -0.00, 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: Trabectedin

DBごとのヒット数: ALL 1 KG 1

FlavonoidSearch最大スコア MS2: -, MS3: -

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
C39H43O11N3S	761.26183	-0.979	Trabectedin	HMDB: HMDB0015609, HMDB0251695 KEGG: C16875 KNApSAcK: C00044733

Level: 2, プリカーサーm/z: 762.26807

Splash: splash10-0ue9-0000079100-e07e73d0aeedb218809e

m/z	Int.	NL	Rel.Int.
503.15	763	259	1000
632.12	757	130	991
744.21	119	18	156
325.04	87	437	113
614.11	82	148	106
615.13	62	147	80
633.07	60	129	78

Level: 3, プリカーサーm/z: 632.13727

Splash: splash10-0udi-0000091000-4f08d359eb6026bf8f90

m/z	Int.	NL	Rel.Int.
503.19	368	129	1000
614.17	46	18	124
325.15	24	307	64

Level: 3, プリカーサーm/z: 503.15509

Splash: splash10-004i-0229000000-6e8126f3c36f05d5165d

m/z	Int.	NL	Rel.Int.
325.04	283	178	1000
247.96	86	255	302
176.92	71	326	252

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1(1(O-Coumaroyl)-(E)-4-hydroxyprenyl))-B(2OH)	2'-Hydroxychalcone	Demethoxyisogemichalcone C
[CCS-type derivative / [2',3]-Prenyloxidoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2',3]-Prenyloxidoflavone	Cycloheterophyllin
[CCS-type derivative / [2',3]-Isopropenylethanoflavone]-A(2OH, 1(C-Prenyl))-B(2OH, 1(1([2,3:@@]-(6,6-Dimethylpyrano))))	CCS-type derivative / [2',3]-Isopropenylethanoflavone	Artonin N
[CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2,2a,5:3',2',3]-7,7-Dimethyltetrahydroisobenzofuranoflavone	Artonin F
[CCS-type derivative / [2,2a,5:3',2',3]-7-Methyl-7-(4-Methyl-3-pentenyl)tetrahydroisobenzofuranoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	CCS-type derivative / [2,2a,5:3',2',3]-7-Methyl-7-(4-Methyl-3-pentenyl)tetrahydroisobenzofuranoflavone	Artonin M
[UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethanoflavone]-A(2OH, 1(C-Prenyl))-B(1OH, 1(C-Prenyl))	UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethanoflavone	Artonin O
[Coumaranochromon]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Coumaranochromon	Euchretin A