Exact Mass: 625.2085336
Exact Mass Matches: 625.2085336
Found 64 metabolites which its exact mass value is equals to given mass value 625.2085336,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Petunidin 3-rutinoside
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium
Petunidin 3-rutinoside is found in banana. Petunidin 3-rutinoside is isolated from Morus sp.
Peonidin 3-sophoroside
3-{[(2R,3S,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1λ⁴-chromen-1-ylium
Peonidin 3-sophoroside is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Petunidin 3-rhamnoside 5-glucoside
2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1λ⁴-chromen-1-ylium
Petunidin 3-rhamnoside 5-glucoside is found in common pea. Petunidin 3-rhamnoside 5-glucoside is isolated from the Leguminosae. Isolated from the Leguminosae. Petunidin 3-rhamnoside 5-glucoside is found in pulses and common pea.
4'-O-Methyldelphinidin 3-O-rutinoside
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium
4-O-Methyldelphinidin 3-O-rutinoside is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Dansylglutamyl-glycyl-arginine chloromethyl ketone
4-{[({1-chloro-6-[(diaminomethylidene)amino]-2-oxohexan-3-yl}carbamoyl)methyl]carbamoyl}-4-[5-(dimethylamino)naphthalene-1-sulfonamido]butanoic acid
Peonidin 3,5-diglucoside
7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3,5-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-1λ⁴-chromen-1-ylium
Peonidin 3,5-diglucoside is a member of the class of compounds known as anthocyanidin-5-o-glycosides. Anthocyanidin-5-o-glycosides are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C5-position. Peonidin 3,5-diglucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Peonidin 3,5-diglucoside can be found in chives, common grape, pineapple, and sea-buckthornberry, which makes peonidin 3,5-diglucoside a potential biomarker for the consumption of these food products.
GR 122222X
N-[N-[N-(1-L-Alanyl-3-hydroxyprolyl)-L-seryl]-S-[(2-carboxy-4,6-dihydroxy-3-methylphenyl)methyl]-L-cysteinyl]-L-alanine
Peonin
3,5-Bis (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium
Petunidin 3-rhamnoside-5-glucoside
3,5,7,3,4-Pentahydroxy-5-methoxyflavylium 3-rhamnoside-5-glucoside
Peonidin-3,5-O-di-beta-glucopyranoside
(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
Acquisition and generation of the data is financially supported in part by CREST/JST.
Glu Glu Trp Tyr
(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid
Glu Glu Tyr Trp
(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid
Glu Trp Glu Tyr
(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-indol-3-yl)propanamido]-4-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid
Glu Trp Tyr Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid
Glu Tyr Glu Trp
(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]-4-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid
Glu Tyr Trp Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-indol-3-yl)propanamido]pentanedioic acid
Trp Glu Glu Tyr
(4S)-4-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carboxybutanamido]-4-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid
Trp Glu Tyr Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid
Trp Tyr Glu Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]pentanedioic acid
Tyr Glu Glu Trp
(4S)-4-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]-4-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoic acid
Tyr Glu Trp Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]-3-(1H-indol-3-yl)propanamido]pentanedioic acid
Tyr Trp Glu Glu
(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-carboxybutanamido]pentanedioic acid
Petunidin 3-rhamnoside 5-glucoside
2-(3,4-dihydroxy-5-methoxyphenyl)-7-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-1$l^{4}-chromen-1-ylium
4'-O-Methyldelphinidin 3-O-rutinoside
2-(3,5-dihydroxy-4-methoxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium
(S)-N,N-Dimethyl-1-[(R)-1,2-bis-(diphenylphosphino)ferrocenylethylamine
(S)-N,N-Dimethyl-1-[(R)-1,2-bis-(diphenylphosphino)ferrocenylethylamine
CYCLOHEXANAMINIUM ((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)METHYL HYDROGENDIPHOSPHATE
CYCLOHEXANAMINIUM ((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)METHYL HYDROGENDIPHOSPHATE
[R,R]-1-[1-dimethylaminoethyl]-1,2-bis[diphenylphosphino]ferrocene
[R,R]-1-[1-dimethylaminoethyl]-1,2-bis[diphenylphosphino]ferrocene
Tetrabutylphosphoniumbis(4-methyl-1,2-benzenedithiolato)niccolate(III)
Tetrabutylphosphoniumbis(4-methyl-1,2-benzenedithiolato)niccolate(III)
Glycine, N-[2-[[(9H-fluoren-9-ylMethoxy)carbonyl]aMino]ethyl]-N-[[2-oxo-4-[[(phenylMethoxy)carbonyl]aMino]-1(2H)-pyriMidinyl]acetyl]-
Glycine, N-[2-[[(9H-fluoren-9-ylMethoxy)carbonyl]aMino]ethyl]-N-[[2-oxo-4-[[(phenylMethoxy)carbonyl]aMino]-1(2H)-pyriMidinyl]acetyl]-
Dansylglutamyl-glycyl-arginine chloromethyl ketone
4-{[({1-chloro-6-[(diaminomethylidene)amino]-2-oxohexan-3-yl}carbamoyl)methyl]carbamoyl}-4-[5-(dimethylamino)naphthalene-1-sulfonamido]butanoic acid
4-Nitrophenyl Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranoside
4-Nitrophenyl Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranoside
C24H35NO18 (625.1854050000001)
N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]benzenesulfonamide
C29H43N3O8S2 (625.2491438000001)
(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
(2S,3R,4S,5S,6R)-2-[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromenylium-5-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
(2s)-2-({[(4r,7s)-7-({[(2s,3r)-1-[(2s)-2-aminopropanoyl]-3-hydroxypyrrolidin-2-yl](hydroxy)methylidene}amino)-6,12,14-trihydroxy-11-methyl-10-oxo-3,4,7,8-tetrahydro-1h-9,2,5-benzoxathiazacyclododecin-4-yl](hydroxy)methylidene}amino)propanoic acid
(2s)-2-({[(4r,7s)-7-({[(2s,3r)-1-[(2s)-2-aminopropanoyl]-3-hydroxypyrrolidin-2-yl](hydroxy)methylidene}amino)-6,12,14-trihydroxy-11-methyl-10-oxo-3,4,7,8-tetrahydro-1h-9,2,5-benzoxathiazacyclododecin-4-yl](hydroxy)methylidene}amino)propanoic acid
(2s,3r,4r,5r,6s)-3-{[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-(c-hydroxycarbonimidoyl)-3-[(1-hydroxyethylidene)amino]oxan-2-yl]oxy}-4-hydroxy-5-[(hydroxymethylidene)amino]-6-{[(2s,3r,4r,5r)-1,4,5-trihydroxy-2-[(1-hydroxyethylidene)amino]hexan-3-yl]oxy}oxane-2-carboximidic acid
(2s,3r,4r,5r,6s)-3-{[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-(c-hydroxycarbonimidoyl)-3-[(1-hydroxyethylidene)amino]oxan-2-yl]oxy}-4-hydroxy-5-[(hydroxymethylidene)amino]-6-{[(2s,3r,4r,5r)-1,4,5-trihydroxy-2-[(1-hydroxyethylidene)amino]hexan-3-yl]oxy}oxane-2-carboximidic acid
3-{[4,5-dihydroxy-6-(c-hydroxycarbonimidoyl)-3-[(1-hydroxyethylidene)amino]oxan-2-yl]oxy}-4-hydroxy-5-[(hydroxymethylidene)amino]-6-({1,4,5-trihydroxy-2-[(1-hydroxyethylidene)amino]hexan-3-yl}oxy)oxane-2-carboximidic acid
3-{[4,5-dihydroxy-6-(c-hydroxycarbonimidoyl)-3-[(1-hydroxyethylidene)amino]oxan-2-yl]oxy}-4-hydroxy-5-[(hydroxymethylidene)amino]-6-({1,4,5-trihydroxy-2-[(1-hydroxyethylidene)amino]hexan-3-yl}oxy)oxane-2-carboximidic acid
(1r,2s,5s,6s,7s,8s,9s,12s)-5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
(1r,2s,5s,6s,7s,8s,9s,12s)-5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
(1s,2s,5s,6s,7r,8s,9r,12r)-5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
(1s,2s,5s,6s,7r,8s,9r,12r)-5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
3-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1λ⁴-chromen-1-ylium
3-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3s,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1λ⁴-chromen-1-ylium
(2s)-2-({[(4s,7s)-7-({[(2s,3r)-1-[(2s)-2-aminopropanoyl]-3-hydroxypyrrolidin-2-yl](hydroxy)methylidene}amino)-6,12,14-trihydroxy-11-methyl-10-oxo-3,4,7,8-tetrahydro-1h-9,2,5-benzoxathiazacyclododecin-4-yl](hydroxy)methylidene}amino)propanoic acid
(2s)-2-({[(4s,7s)-7-({[(2s,3r)-1-[(2s)-2-aminopropanoyl]-3-hydroxypyrrolidin-2-yl](hydroxy)methylidene}amino)-6,12,14-trihydroxy-11-methyl-10-oxo-3,4,7,8-tetrahydro-1h-9,2,5-benzoxathiazacyclododecin-4-yl](hydroxy)methylidene}amino)propanoic acid
5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
5,8-bis(acetyloxy)-7-(benzoyloxy)-2-hydroxy-2,6,10,10-tetramethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl 1-methyl-6-oxopyridine-3-carboxylate
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium
2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium