Exact Mass: 625.2069

Exact Mass Matches: 625.2069

Found 68 metabolites which its exact mass value is equals to given mass value 625.2069, 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

C28H33O16 (625.1769)

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

C28H33O16 (625.1769)

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

C28H33O16+ (625.1769)

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

C28H33O16 (625.1769)

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

C26H36ClN7O7S (625.2085)

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

C28H33O16 (625.1769)

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.

Peonidin 3-galactoside-5-glucoside

C28H33O16 (625.1769)

Petunidin 3-rutinoside

3,5,7,3,4-Pentahydroxy-5-methoxyflavylium 3-rhamnosyl- (1->6) -glucoside

C28H33O16 (625.1769)

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

C26H35N5O11S (625.2054)

Reissantin A

C33H39NO11 (625.2523)

Peonidin 3-sophoroside

C28H33O16 (625.1769)

Peonidin 3-gentiobioside

3,5,7,4-Tetrahydroxy-3-methoxyflavylium 3-glucosyl- (1->6) -glucoside

C28H33O16 (625.1769)

Malvidin 3-O-beta-D-sambubioside

C28H33O16 (625.1769)

Peonin

3,5-Bis (beta-D-glucopyranosyloxy) -7-hydroxy-2- (4-hydroxy-3-methoxyphenyl) -1-benzopyrylium

C28H33O16 (625.1769)

Petunidin 3-rhamnoside-5-glucoside

3,5,7,3,4-Pentahydroxy-5-methoxyflavylium 3-rhamnoside-5-glucoside

C28H33O16 (625.1769)

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

[C28H33O16]+ (625.1769)

Acquisition and generation of the data is financially supported in part by CREST/JST.

Peonidin-3,5-O-di-beta-glucoside

C28H33O16 (625.1769)

Peonidin-3,5-O-di-beta-glucoside

[C28H33O16]+ (625.1769)

Annotation level-1

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

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

C30H35N5O10 (625.2384)

Flupenthixol-O-glucuronide

C29H34F3N3O7S (625.2069)

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

C28H33O16 (625.1769)

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

C28H33O16 (625.1769)

Petunidin 3-rutinoside

C28H33O16+ (625.1769)

(S)-N,N-Dimethyl-1-[(R)-1,2-bis-(diphenylphosphino)ferrocenylethylamine

C38H37FeNP2 (625.175)

p-Nitrophenyl β-D-Cellotrioside

C24H35NO18 (625.1854)

CYCLOHEXANAMINIUM ((2R,3S,4R,5R)-5-(6-AMINO-9H-PURIN-9-YL)-3,4-DIHYDROXYTETRAHYDROFURAN-2-YL)METHYL HYDROGENDIPHOSPHATE

C22H41N7O10P2 (625.239)

Dansyl-Glu-Gly-Arg-chloromethylketone

C26H36ClN7O7S (625.2085)

[R,R]-1-[1-dimethylaminoethyl]-1,2-bis[diphenylphosphino]ferrocene

C38H37FeNP2 (625.175)

fmoc-tyr(tbu)-opfp

C34H28F5NO5 (625.1888)

Tetrabutylphosphoniumbis(4-methyl-1,2-benzenedithiolato)niccolate(III)

C30H48NiPS4 (625.173)

Glycine, N-[2-[[(9H-fluoren-9-ylMethoxy)carbonyl]aMino]ethyl]-N-[[2-oxo-4-[[(phenylMethoxy)carbonyl]aMino]-1(2H)-pyriMidinyl]acetyl]-

C33H31N5O8 (625.2173)

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

C26H36ClN7O7S (625.2085)

4-Nitrophenyl Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranosyl-(1->4)-Beta-D-Glucopyranoside

C24H35NO18 (625.1854)

Peonidin 3-O-sophoroside

C28H33O16+ (625.1769)

4-O-Methyldelphinidin 3-O-rutinoside

C28H33O16+ (625.1769)

N,N,N-triacetylchitotriono-1,5-lactone

C24H39N3O16 (625.233)

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 (625.2491)

Petunidin 3-rhamnoside 5-glucoside

C28H33O16+ (625.1769)

Peonidin-3,5-O-di-beta-glucoside

C28H33O16+ (625.1769)

Peonidin-3,5-O-di-beta-glucopyranoside

C28H33O16+ (625.1769)

(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

C28H33O16+ (625.1769)

Petunidin 3-O-sophoroside

C28H33O16 (625.1769)

(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

C26H35N5O11S (625.2054)

(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

C23H39N5O15 (625.2443)

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

C23H39N5O15 (625.2443)

(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

C33H39NO11 (625.2523)

(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

C33H39NO11 (625.2523)

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

[C28H33O16]+ (625.1769)

17-(acetyloxy)-12-[3-(acetyloxy)-4-methoxyphenyl]-8,16-dimethoxy-3-oxo-4-oxa-1-azapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-2(11),5(10),6,8,12,14(19),15,17,20-nonaen-7-yl acetate

C34H27NO11 (625.1584)

(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

C26H35N5O11S (625.2054)

17-(acetyloxy)-12-[4-(acetyloxy)-3-methoxyphenyl]-8,16-dimethoxy-3-oxo-4-oxa-1-azapentacyclo[11.8.0.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁹]henicosa-2(11),5(10),6,8,12,14(19),15,17,20-nonaen-7-yl acetate

C34H27NO11 (625.1584)

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

C33H39NO11 (625.2523)

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

[C28H33O16]+ (625.1769)