ピーク情報

トマト Micro-Tom 花

pos

Peak #13079 MN MID: SE203_S31_M90

m/z: 583.41588, RT: 100.37, 強度: 10778, ログ強度: 0.37, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 9

DB検索結果: (22 names) (3S,4R,3'R)-7',8'-Didehydro-beta,beta-carotene-3,4,3'-triol;(3R,3'S,6'R)-7,8-Didehydro-beta,epsilon-carotene-3,3',6'-triol;alpha-Cryptoeutreptiellanone;(3S,3'R,5R,6S,6'R)-3,6-Epoxy-5,6-dihydro-3'-hydr...

DBごとのヒット数: ALL 18 KG 3 KN 11 LM 4

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
C40H54O3	582.40730	2.242	Pectenol A	KNApSAcK: C00022909 LipidMAPS: LMPR01070069, LMPR01070070
C40H54O3	582.40730	2.242	Gobiusxanthin	KNApSAcK: C00022917 LipidMAPS: LMPR01070195
C40H54O3	582.40730	2.242	alpha-Cryptoeutreptiellanone	KNApSAcK: C00023041 LipidMAPS: LMPR01070939
C40H54O3	582.40730	2.242	1',2'-Dihydroxy-3',4'-didehydro-1',2'-dihydro-beta,psi-caroten-4-one	LipidMAPS: LMPR01070191, LMPR01070573
C40H54O3	582.40730	2.242	(3S,6R,6'S)-3,6-Dihydroxy-2',3'-didehydro-7,8-dihydro-gamma,epsilon-caroten-8-one	LipidMAPS: LMPR01070981
C40H54O3	582.40730	2.242		LipidMAPS: LMPR01070216
C40H54O3	582.40730	2.242	Diadinochrome	KNApSAcK: C00023239 LipidMAPS: LMPR01070715, LMPR01070716, LMPR01070717
C40H54O3	582.40730	2.242	4-Ketolutein	KNApSAcK: C00007425, C00023006, C00023007 LipidMAPS: LMPR01070027, LMPR01070028, LMPR01070045, LMPR01070046, LMPR01070937
C40H54O3	582.40730	2.242	Diatoxanthin 3,6-epoxide	HMDB: HMDB0037794 KNApSAcK: C00023238 LipidMAPS: LMPR01070718
C40H54O3	582.40730	2.242	Deinoxanthin	KEGG: C16347 KNApSAcK: C00023009, C00053020 LipidMAPS: LMPR01070182, LMPR01070575
C40H54O3	582.40730	2.242	Flexixanthin	KNApSAcK: C00023010 LipidMAPS: LMPR01070102
C40H54O3	582.40730	2.242	(3'R,6'R)-3',4-dihydroxy-epsion,epsilon-carotene-3-one	LipidMAPS: LMPR01070978
C40H54O3	582.40730	2.242	2,3-Dihydroxyechinenone	KNApSAcK: C00023002 LipidMAPS: LMPR01070793, LMPR01070794
C40H54O3	582.40730	2.242	2,3-Dihydroxy-beta,psi-caroten-4-one	KNApSAcK: C00023008 LipidMAPS: LMPR01070574
C40H54O3	582.40730	2.242	Capsanthone	HMDB: HMDB0303575 KNApSAcK: C00023053 LipidMAPS: LMPR01071003
C40H54O3	582.40730	2.242	Adonixanthin	KEGG: C15968 KNApSAcK: C00000917 LipidMAPS: LMPR01070016
C40H54O3	582.40730	2.242	7',8'-Didehydrodeepoxyneoxanthin	KNApSAcK: C00023233 LipidMAPS: LMPR01070650
C40H54O3	582.40730	2.242	Diadinoxanthin	KEGG: C19921 KNApSAcK: C00022941, C00022942 LipidMAPS: LMPR01070719, LMPR01070720

MSnスペクトル情報

Level: 2, プリカーサーm/z: 583.41510

Splash: splash10-00dr-0000900000-b171d6031680b906cdab

m/z	Int.	NL	Rel.Int.
420.31	2225	163	1000
438.33	1268	145	569
565.50	184	18	82
566.50	152	17	68

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1OMe, 1(5-Hydroxy-1,7-bis-(4-hydroxyphenyl)-hept-2-enyl))-B(1OH)	2'-Hydroxychalcone	Calyxin B
[Flavanone]-A(1OH, 1OMe, 1(5-Hydroxy-1,7-bis-(4-hydroxyphenyl)-hept-2-enyl))-B(1OH)	Flavanone	Calyxin C
[Flavanone]-A(1OH, 1OMe, 1(2-(4-Hydroxyphenyl)-6-(2-(4-hydroxyphenyl)ethyl)-tetrahydropyran-4-yl))-B(1OH)	Flavanone	Calyxin G
[Flavanone]-A(1OMe, 1([2,3:@@]-(4-(2-Hydroxy-4-(4-hydroxyphenyl)-butyl)-6-(4-hydroxyphenyl)-4,5-dihydropyrano)))-B(1OH)	Flavanone	Calyxin M
[Flavone]-A(2OH, 1(1(O-Vanilloyl)-C-Glu))-B(1OH)	Flavone	2''-O-Vanilloylvitexin
[Flavone]-A(2OH, 1(1(O-p-Methoxybenzoyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-p-methoxybenzoate
[4-substituted Flavan 3-ol (4-(2,4,6-Trihydroxyphenyl))]-A(2OH)-B(3OH)-C(1(O-Galloyl))	4-substituted Flavan 3-ol	4-(2,4,6-Trihydroxyphenyl)gallocatechin 3-O-galloate

Level: 3, プリカーサーm/z: 438.32849

Splash: splash10-0udl-0090100000-efc8d811221ba0c24a0b

m/z	Int.	NL	Rel.Int.
204.15	311	234	1000
292.31	209	146	670
421.42	74	17	237
146.99	46	291	146
274.56	34	164	108
420.45	31	18	98
218.15	25	220	79
275.30	19	163	61

Level: 3, プリカーサーm/z: 420.31305

Splash: splash10-0uxr-0090000000-37cd15e6417fa78779c6

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

m/z	Int.	NL	Rel.Int.
217.13	292	203	1000
203.10	281	217	962
204.09	225	216	770
275.27	182	145	623
274.18	69	146	235
147.03	68	273	232
218.10	45	202	154