Exact Mass: 1420.6775

Exact Mass Matches: 1420.6775

Found 7 metabolites which its exact mass value is equals to given mass value 1420.6775, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Soyasaponin A-c

6-({9-[(3,5-dihydroxy-4-{[3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]oxy}oxan-2-yl)oxy]-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl}oxy)-5-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

C67H104O32 (1420.651)


Soyasaponin a-c is a member of the class of compounds known as triterpene saponins. Triterpene saponins are glycosylated derivatives of triterpene sapogenins. The sapogenin moiety backbone is usually based on the oleanane, ursane, taraxastane, bauerane, lanostane, lupeol, lupane, dammarane, cycloartane, friedelane, hopane, 9b,19-cyclo-lanostane, cycloartane, or cycloartanol skeleton. Soyasaponin a-c is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Soyasaponin a-c can be found in soy bean, which makes soyasaponin a-c a potential biomarker for the consumption of this food product.

   

Soyasaponin Ac

5-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-[[9-[3,5-dihydroxy-4-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4-dihydroxyoxane-2-carboxylic acid

C67H104O32 (1420.651)


   

[(3s,9s,12s,15s,17s,25r,28s,31s,34s,40s,43r,46s,48s,56s)-11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-[(1r)-1-hydroxyethyl]-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

[(3s,9s,12s,15s,17s,25r,28s,31s,34s,40s,43r,46s,48s,56s)-11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-[(1r)-1-hydroxyethyl]-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

C68H92N16O18 (1420.6775)


   

[(3s,9s,12s,15s,17s,25s,28s,31s,34s,40s,43r,46s,48s,56s)-11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-[(1r)-1-hydroxyethyl]-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

[(3s,9s,12s,15s,17s,25s,28s,31s,34s,40s,43r,46s,48s,56s)-11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-[(1r)-1-hydroxyethyl]-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

C68H92N16O18 (1420.6775)


   

[11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-(1-hydroxyethyl)-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

[11,14,30,33,36,39,42,45-octahydroxy-28,31,40-tris(c-hydroxycarbonimidoylmethyl)-9-(1-hydroxyethyl)-12-(hydroxymethyl)-17,48-bis(3-methylbut-2-en-1-yl)-43-(2-methylpropyl)-2,8,27-trioxo-1,7,10,13,24,26,29,32,35,38,41,44,55-tridecaazaoctacyclo[44.10.0.0³,⁷.0¹⁵,²⁶.0¹⁷,²⁵.0¹⁸,²³.0⁴⁸,⁵⁶.0⁴⁹,⁵⁴]hexapentaconta-10,13,18,20,22,29,32,35,38,41,44,49,51,53-tetradecaen-34-yl]acetic acid

C68H92N16O18 (1420.6775)


   

methyl (2r,3r,4s,5r,6s)-6-{[(3r,4s,4ar,6as,6br,8ar,12ar,14ar,14bs)-8a-({[(2r,3r,4s,5r,6s)-5-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-{[(2r,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-methyl-4-{[(2s,3s,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}carbonyl)-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,4-dihydroxy-5-{[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylate

methyl (2r,3r,4s,5r,6s)-6-{[(3r,4s,4ar,6as,6br,8ar,12ar,14ar,14bs)-8a-({[(2r,3r,4s,5r,6s)-5-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-3,4-dihydroxy-6-methyl-5-{[(2r,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}-6-methyl-4-{[(2s,3s,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxan-2-yl]oxy}carbonyl)-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,4-dihydroxy-5-{[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxane-2-carboxylate

C67H104O32 (1420.651)


   

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1r,2s,4s,7s,8r,9s,12s,13s,16s,18s)-16-{[(2r,3r,4r,5r,6r)-5-{[(2s,3r,4s,5r,6r)-3-{[(2s,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-methoxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-[(2r)-4-[(1r,2s,4s,7s,8r,9s,12s,13s,16s,18s)-16-{[(2r,3r,4r,5r,6r)-5-{[(2s,3r,4s,5r,6r)-3-{[(2s,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-6-methoxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C64H108O34 (1420.6722)