Exact Mass: 1081.3036

Exact Mass Matches: 1081.3036

Found 14 metabolites which its exact mass value is equals to given mass value 1081.3036, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside

3-[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-({[(2E)-3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-7-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C48H57O28+ (1081.3036)


Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside is found in brassicas. Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside is isolated from red cabbage (Brassica oleracea var. Red Danish). Isolated from red cabbage (Brassica oleracea variety Red Danish). Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside is found in brassicas.

   

Cyanidin 3-[6'-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside

3-{[(2R,3R,4S,5S,6R)-4,5-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-({[(2E)-3-(4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-7-hydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C48H57O28 (1081.3036)


Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside is a member of the class of compounds known as anthocyanidin 3-o-6-p-coumaroyl glycosides. Anthocyanidin 3-o-6-p-coumaroyl glycosides are anthocyanidin 3-O-glycosides where the carbohydrate moiety is esterified at the C6 position with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring. Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside can be found in cauliflower, which makes cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside a potential biomarker for the consumption of this food product.

   

Pelargonidin 3-[6-(3-glucosylcaffeyl)sophoroside]-5-glucoside

Pelargonidin 3-[6-(3-glucosylcaffeyl)sophoroside]-5-glucoside

C48H57O28 (1081.3036)


   

Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside]-5-glucoside

Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside]-5-glucoside

C48H57O28 (1081.3036)


   

Delphinidin 3-O-[6-O-(4-O-(4-O-(beta-D-glucopyranosyl)-trans-p-coumaroyl)-alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside]-5-O-[beta-D-glucopyranoside]

Delphinidin 3-O-[6-O-(4-O-(4-O-(beta-D-glucopyranosyl)-trans-p-coumaroyl)-alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside]-5-O-[beta-D-glucopyranoside]

C48H57O28 (1081.3036)


   

Delphinidin 3-rutinoside-7-(6-p-coumaroylglucoside)-3-glucoside

Delphinidin 3-rutinoside-7-(6-p-coumaroylglucoside)-3-glucoside

C48H57O28 (1081.3036)


   

Delphinidin 3-rutinoside-7- (6-p-coumaroylglucoside) -3-glucoside

2- (3,4,5-Trihydroxyphenyl) -3- (6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyloxy) -5-hydroxy-7- [ 3-O- [ 6-O- [ 3- (4-hydroxyphenyl) -1-oxo-2-propenyl ] -beta-D-glucopyranosyl ] -beta-D-glucopyranosyloxy ] -1-benzopyrylium

C48H57O28 (1081.3036)


   

Cyanidin 3-[6-(4-glucosylcoumaryl)sophoroside] 5-glucoside

3-[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-({[(2E)-3-(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-7-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C48H57O28 (1081.3036)


   

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (2S)-5-[(1S,5S,6R,7S,9S,10S)-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.17,10.01,6]tridec-2-en-5-yl]-2-methylpentanethioate

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] (2S)-5-[(1S,5S,6R,7S,9S,10S)-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.17,10.01,6]tridec-2-en-5-yl]-2-methylpentanethioate

C41H62N7O19P3S (1081.3034)


   

Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside

Cyanidin 3-[6-(4-glucosyl-p-coumaryl)sophoroside] 5-glucoside

C48H57O28+ (1081.3036)


   

Cyanidin 3-[6'-(4-glucosyl-p-coumaryl)sophoroside]-5-glucoside

Cyanidin 3-[6'-(4-glucosyl-p-coumaryl)sophoroside]-5-glucoside

C48H57O28 (1081.3036)


   

Delphinidin 3-rutinoside-7-(6-p-coumaroylglucoside)-3'-glucoside

Delphinidin 3-rutinoside-7-(6-p-coumaroylglucoside)-3'-glucoside

C48H57O28 (1081.3036)


   

Pelargonidin 3-[6'-(3-glucosylcaffeyl)sophoroside]-5-glucoside

Pelargonidin 3-[6'-(3-glucosylcaffeyl)sophoroside]-5-glucoside

C48H57O28 (1081.3036)


   

3-{[(2s,3r,4s,5s,6r)-6-({[(2r,3s,4s,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2e)-3-(4-{[(2s,3s,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-hydroxy-5-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium

3-{[(2s,3r,4s,5s,6r)-6-({[(2r,3s,4s,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2e)-3-(4-{[(2s,3s,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-7-hydroxy-5-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1λ⁴-chromen-1-ylium

[C48H57O28]+ (1081.3036)