Exact Mass: 712.2942

Exact Mass Matches: 712.2942

Found 14 metabolites which its exact mass value is equals to given mass value 712.2942, within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error 0.0002 dalton.

Nomilinic acid 17-glucoside

5-[1-(acetyloxy)-2-carboxyethyl]-2-[furan-3-yl({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3H-spiro[naphthalene-1,2-oxirane]-3-carboxylic acid

C34H48O16 (712.2942)

Nomilinic acid 17-glucoside is found in citrus. Nomilinic acid 17-glucoside is isolated from lemons Citrus limon. Isolated from lemons Citrus limon. Nomilinic acid 17-glucoside is found in citrus.

Nomilinic acid 17-O-beta-D-glucoside

(2S,3S,4aR,5R,6R,8aR)-5-[(1R)-1-(acetyloxy)-2-carboxyethyl]-2-[(R)-(furan-3-yl)({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-octahydro-2H-spiro[naphthalene-1,2-oxirane]-3-carboxylic acid

C34H48O16 (712.2942)

Nomilinic acid 17-o-beta-d-glucoside is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Nomilinic acid 17-o-beta-d-glucoside can be found in lemon, mandarin orange (clementine, tangerine), and sweet orange, which makes nomilinic acid 17-o-beta-d-glucoside a potential biomarker for the consumption of these food products.

Nomilinic acid 17-glucoside

5-[1-(acetyloxy)-2-carboxyethyl]-2-[furan-3-yl({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-octahydro-2H-spiro[naphthalene-1,2-oxirane]-3-carboxylic acid

C34H48O16 (712.2942)

benzene-1,3-dicarboxylic acid,2-benzofuran-1,3-dione,2-ethyl-2-(hydroxymethyl)propane-1,3-diol,hexanedioic acid,hexane-1,6-diol

C34H48O16 (712.2942)

(1r,2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

(1r,2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

C34H48O16 (712.2942)

(2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[furan-3-yl({[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

(2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[furan-3-yl({[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

C34H48O16 (712.2942)

(1s,2s,3'r,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

(1s,2s,3'r,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

C34H48O16 (712.2942)

(2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

(2s,3's,4ar,5r,6r,8ar)-5-[(1r)-1-(acetyloxy)-2-carboxyethyl]-2-[(s)-furan-3-yl({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

C34H48O16 (712.2942)

2-{4-[4-({3,5-dimethoxy-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}methyl)-3-(hydroxymethyl)oxolan-2-yl]-2,6-dimethoxyphenoxy}-6-methyloxane-3,4,5-triol

C34H48O16 (712.2942)

(2r,3s,4s,5s,6r)-2-(4-{[(3r,4r,5s)-5-(3,5-dimethoxy-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl}-2,6-dimethoxyphenoxy)-6-methyloxane-3,4,5-triol

(2r,3s,4s,5s,6r)-2-(4-{[(3r,4r,5s)-5-(3,5-dimethoxy-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl}-2,6-dimethoxyphenoxy)-6-methyloxane-3,4,5-triol

C34H48O16 (712.2942)

5-[1-(acetyloxy)-2-carboxyethyl]-2-[furan-3-yl({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})methyl]-6-(2-hydroxypropan-2-yl)-2,5,8a-trimethyl-8-oxo-tetrahydro-3h-spiro[naphthalene-1,2'-oxirane]-3'-carboxylic acid

C34H48O16 (712.2942)