Exact Mass: 757.2191086

Exact Mass Matches: 757.2191086

Found 57 metabolites which its exact mass value is equals to given mass value 757.2191086, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Bisdemalonylsalvianin

Pelargonidin 3-O-(6-caffeoyl-beta-D-glucoside) 5-O-beta-D-glucoside

C36H37O18+ (757.1979802000001)


   

Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside

Cyanidin 3-O-rutinoside 5-O-beta-D-glucoside

C33H41O20+ (757.2191086)


An anthocyanin cation that is cyanidin in which the hydroxyl hydrogens at positions 3 and 5 are replaced by rutinosyl and glucosyl residues respectively.

   

Cyanidin 3-O-beta-D-glucoside 5-O-(6-coumaroyl-beta-D-glucoside)

Cyanidin 3-O-beta-D-glucoside 5-O-(6-coumaroyl-beta-D-glucoside)

C36H37O18 (757.1979802000001)


   

Pelargonidin 3-glucoside 5-caffeoylglucoside

Pelargonidin 3-glucoside 5-caffeoylglucoside

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(2G-glucosylrutinoside)

3-[(4,5-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1lambda4-chromen-1-ylium

C33H41O20+ (757.2191086)


Isolated from redcurrant berries (Ribes rubrum). Cyanidin 3-(2G-glucosylrutinoside) is found in many foods, some of which are lowbush blueberry, sour cherry, purple mangosteen, and blackcurrant. Cyanidin 3-(2G-glucosylrutinoside) is found in black chokeberry. Cyanidin 3-(2G-glucosylrutinoside) is isolated from redcurrant berries (Ribes rubrum).

   

Perillanin

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

C36H37O18 (757.1979802000001)


Perillanin is found in green vegetables. Perillanin is isolated from leaves of Perilla nankinensi

   

Pelargonidin 3-sophoroside 5-glucoside

3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-2-(4-hydroxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C33H41O20+ (757.2191086)


Present in roots of radish (Raphanus sativus) and Brassica oleracea. Pelargonidin 3-sophoroside 5-glucoside is found in many foods, some of which are brassicas, poppy, root vegetables, and scarlet bean. Pelargonidin 3-sophoroside 5-glucoside is found in brassicas. Pelargonidin 3-sophoroside 5-glucoside is present in roots of radish (Raphanus sativus) and Brassica oleracea.

   

Peonidin 3-sambubioside 5-glucoside

3-{[(2S,3R,4S,5S,6R)-3-{[(2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C33H41O20+ (757.2191086)


Peonidin 3-sambubioside 5-glucoside is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]

   

Cyanidin 3-glucosyl-rutinoside

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

C33H41O20 (757.2191086)


Cyanidin 3-rhamnosyl-glucosyl-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cyanidin 3-rhamnosyl-glucosyl-glucoside can be found in asparagus and olive, which makes cyanidin 3-rhamnosyl-glucosyl-glucoside a potential biomarker for the consumption of these food products.

   

Pelargonidin 3-O-[b-D-Glucopyranosyl-(1->2)-b-D-glucopyranoside] 7-O-b-D-glucopyranoside

3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1λ⁴-chromen-1-ylium

C33H41O20+ (757.2191086)


Pelargonidin 3-o-[b-d-glucopyranosyl-(1->2)-b-d-glucopyranoside] 7-o-b-d-glucopyranoside is a member of the class of compounds known as anthocyanidin-7-o-glycosides. Anthocyanidin-7-o-glycosides are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C7-position. Pelargonidin 3-o-[b-d-glucopyranosyl-(1->2)-b-d-glucopyranoside] 7-o-b-d-glucopyranoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Pelargonidin 3-o-[b-d-glucopyranosyl-(1->2)-b-d-glucopyranoside] 7-o-b-d-glucopyranoside can be found in scarlet bean, which makes pelargonidin 3-o-[b-d-glucopyranosyl-(1->2)-b-d-glucopyranoside] 7-o-b-d-glucopyranoside a potential biomarker for the consumption of this food product.

   

Perillanin

5- (beta-D-Glucopyranosyloxy) -7-hydroxy-2- (3,4-dihydroxyphenyl) -3- [ [ 6-O- [ 3- (4-hydroxyphenyl) acryloyl ] -beta-D-glucopyranosyl ] oxy ] -1-benzopyrylium

C36H37O18 (757.1979802000001)


   

Cyanidin 3-rutinoside-5-glucoside

Cyanidin 3-rutinoside-5-glucoside

C33H41O20 (757.2191086)


   

Cyanidin 3-galactoside-5-(6-p-coumarylglucoside)

Cyanidin 3-galactoside-5-(6-p-coumarylglucoside)

C36H37O18 (757.1979802000001)


   

Pelargonidin 3-gentiotrioside

3,5,7,4-Tetrahydroxyflavylium 3-gentiotrioside

C33H41O20 (757.2191086)


   

Pelargonidin 3-sophoroside-7-glucoside

3,5,7,4-Tetrahydroxyflavylium 3-glucosyl- (1->2) -glucoside-7-glucoside

C33H41O20 (757.2191086)


   

Cyanidin 3-rutinoside-3-glucoside

3,5,7,3,4-Pentahydroxyflavylium 3-rutinoside-3-glucoside

C33H41O20 (757.2191086)


   

Vincanin A

3,5,7,3,4,5-Hexahydroxyflavylium 3-rhamnosyl- (1->6) -galactoside-5-rhamnoside

C33H41O20 (757.2191086)


   

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

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

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(6-p-coumarylsophoroside)

Cyanidin 3-(6-p-coumarylsophoroside)

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(4-caffeylrutinoside)

Cyanidin 3-(4-caffeylrutinoside)

C36H37O18 (757.1979802000001)


   

Cyanidin 3-O-beta-rutinoside-7-O-beta-glucoside

3,5,7,3,4-Pentahydroxyflavylium 3-O-beta-rutinoside-7-O-beta-glucoside

C33H41O20 (757.2191086)


   

Pelargonidin 3-[2-(2-trans-caffeoyl-beta-D-glucopyranosyl)-beta-D-galactopyranoside]

3,5,7,4-Tetrahydroxyflavylium 3- [ 2"- (2"-trans-caffeoyl-beta-D-glucopyranosyl) -beta-D-galactopyranoside ]

C36H37O18 (757.1979802000001)


   

Petunidin 3-[6-(rhamnosyl)-2-(xylosyl)glucoside]

Petunidin 3-[6-(rhamnosyl)-2-(xylosyl)glucoside]

C33H41O20 (757.2191086)


   

Asparagus officinalis Anthocyanin A1

Asparagus officinalis Anthocyanin A1

C33H41O20+ (757.2191086)


   

Cyanidin 3-(6-(Z)-p-coumarylsophoroside)

Cyanidin 3-(6-(Z)-p-coumarylsophoroside)

C36H37O18 (757.1979802000001)


   

Gentiocyanin C

Cyanidin 3-O-beta-D-glucoside 5-O-(6-coumaroyl-beta-D-glucoside)

C36H37O18+ (757.1979802000001)


   

Bisdemalonylsalvianin

3,5,7,4-Tetrahydroxyflavylium 3- (6"-p-caffeylglucoside) -5-glucoside

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(2G-glucosylrutinoside)

3- [ 2-O-beta-D-Glucopyranosyl-6-O- (6-deoxy-alpha-L-mannopyranosyl) -beta-D-glucopyranosyloxy ] -5,7-dihydroxy-2- (3,4-dihydroxyphenyl) -1-benzopyrylium

C33H41O20+ (757.2191086)


   

Cyanidin 3- (6'-p-coumarylsophoroside)

3,5,7,3,4-Pentahydroxyflavylium 3- (6"-p-coumarylsophoroside)

C36H37O18 (757.1979802000001)


   

Rubrobrassicin

3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7-hydroxy-2-(4-hydroxyphenyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C33H41O20 (757.2191086)


   
   

2-[[4-[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoyl]amino]propanoic acid

NCGC00179986-02!2-[[4-[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoyl]amino]propanoic acid

C36H39NO17 (757.2217884)


   

Cyanidin 3-(2G-glucosylrutinoside)

Cyanidin 3-(2G-glucosylrutinoside)

C33H41O20 (757.2191086)


   

Cyanidin 3-(2G-glucosylrutinoside)

Cyanidin 3-(2G-glucosylrutinoside)

[C33H41O20]+ (757.2191086)


Annotation level-1

   

Peonidin 3-sambubioside 5-glucoside

3-{[(2S,3R,4S,5S,6R)-3-{[(2S,3R,4R,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1$l^{4}-chromen-1-ylium

C33H41O20 (757.2191086)


   

4-nitrophenyl hepta-o-acetyl-beta-lactos

4-nitrophenyl hepta-o-acetyl-beta-lactos

C32H39NO20 (757.2065334)


   

Cyanidin 3-glucosyl-rutinoside

Cyanidin 3-glucosyl-rutinoside

C33H41O20+ (757.2191086)


   

Pelargonidin 3-glucoside 5-caffeoylglucoside

Pelargonidin 3-glucoside 5-caffeoylglucoside

C36H37O18+ (757.1979802000001)


   

[6-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate

[6-[2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychromenylium-3-yl]oxy-3,4-dihydroxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl 3-(4-hydroxyphenyl)prop-2-enoate

C36H37O18+ (757.1979802000001)


   

2-[[4-[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoyl]amino]propanoic acid

2-[[4-[2-[(2S,3R,4S,5S,6R)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-(2-hydroxy-4-methoxy-6-methylbenzoyl)oxy-6-methylbenzoyl]oxy-2-hydroxy-6-methylbenzoyl]amino]propanoic acid

C36H39NO17 (757.2217884)


   

Peonidin 3-sambubioside 5-glucoside

Peonidin 3-sambubioside 5-glucoside

C33H41O20+ (757.2191086)


   

Pelargonidin 3-sophoroside 5-glucoside

Pelargonidin 3-sophoroside 5-glucoside

C33H41O20+ (757.2191086)


   

Cyanidin 3-O-beta-D-glucoside 5-O-(6-coumaroyl-beta-D-glucoside)

Cyanidin 3-O-beta-D-glucoside 5-O-(6-coumaroyl-beta-D-glucoside)

C36H37O18+ (757.1979802000001)


   

Cyanidin 3-(4'-caffeylrutinoside)

Cyanidin 3-(4'-caffeylrutinoside)

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(6'-(Z)-p-coumarylsophoroside)

Cyanidin 3-(6'-(Z)-p-coumarylsophoroside)

C36H37O18 (757.1979802000001)


   

Cyanidin 3-(6'-p-coumarylsophoroside)

Cyanidin 3-(6'-p-coumarylsophoroside)

C36H37O18 (757.1979802000001)


   

Cyanidin 3-rutinoside-3'-glucoside

Cyanidin 3-rutinoside-3'-glucoside

C33H41O20 (757.2191086)


   

Pelargonidin 3-[2'-(2'-trans-caffeoyl-beta-D-glucopyranosyl)-beta-D-galactopyranoside]

Pelargonidin 3-[2'-(2'-trans-caffeoyl-beta-D-glucopyranosyl)-beta-D-galactopyranoside]

C36H37O18 (757.1979802000001)


   

Pelargonidin 3-glucoside-5-caffeoylglucoside

Pelargonidin 3-glucoside-5-caffeoylglucoside

C36H37O18 (757.1979802000001)


   

Pelargonidin 3-O-[b-D-Glucopyranosyl-(1->2)-b-D-glucopyranoside]-7-O-b-D-glucopyranoside

Pelargonidin 3-O-[b-D-Glucopyranosyl-(1->2)-b-D-glucopyranoside]-7-O-b-D-glucopyranoside

C33H41O20 (757.2191086)


   

Peonidin 3-sambubioside-5-glucoside

Peonidin 3-sambubioside-5-glucoside

C33H41O20 (757.2191086)


   

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

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

[C36H37O18]+ (757.1979802000001)


   

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

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

[C33H41O20]+ (757.2191086)