Exact Mass: 1038.5399172
Exact Mass Matches: 1038.5399172
Found 21 metabolites which its exact mass value is equals to given mass value 1038.5399172,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Soyasaponin beta-A
5-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-3,4-dihydroxy-6-({9-[(5-hydroxy-6-methyl-4-oxo-3,4-dihydro-2H-pyran-2-yl)oxy]-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)oxane-2-carboxylic acid
Soyasaponin beta-a 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 beta-a is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Soyasaponin beta-a can be found in soy bean, which makes soyasaponin beta-a a potential biomarker for the consumption of this food product.
Soyasapogenol B base + O-HexA-Pen-dHex, O-C6H7O3
Soyasapogenol B base + O-HexA-Pen-dHex, O-C6H7O3
Annotation level-3
methyl ester of 3-O-alpha-L-arabinopyranosyl(1-3)-beta-D-glucuronopyranosyl-21-O-angeloyl-22-O-2-methylbutanoyl-R1-barrigenol-23-oic acid|TR-saponin B
methyl ester of 3-O-alpha-L-arabinopyranosyl(1-3)-beta-D-glucuronopyranosyl-21-O-angeloyl-22-O-2-methylbutanoyl-R1-barrigenol-23-oic acid|TR-saponin B
3beta-O-{alpha-L-arabinopyranosyl-(1->3)-beta-D-glucuronopyranosyl}-16alpha-acetoxy-21beta-{(Z)-2-methylbut-2-enoyloxy}-22alpha-(2-methylbutanoyloxy)-15alpha,23,28-triihydroxyolean-12-ene|rogchaponin R4
3beta-O-{alpha-L-arabinopyranosyl-(1->3)-beta-D-glucuronopyranosyl}-16alpha-acetoxy-21beta-{(Z)-2-methylbut-2-enoyloxy}-22alpha-(2-methylbutanoyloxy)-15alpha,23,28-triihydroxyolean-12-ene|rogchaponin R4
aethioside A
3beta-O-alpha-L-rhamnopyranosyl-(1-3)-[alpha-L-rhamnopyranosyl-(1-2)]-beta-D-glucopyranosyl-homo-aro-cholest-5-ene-26-O-beta-D-glucopyranoside
Soyasapogenol B base + O-HexA-Pen-dHex, O-C6H7O3(DDMP)
Soyasapogenol B base + O-HexA-Pen-dHex, O-C6H7O3(DDMP)
Annotation level-3
Mupirocin calcium
Mupirocin calcium
D004791 - Enzyme Inhibitors > D011500 - Protein Synthesis Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
methyl 6-{[7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(2-methylbut-2-enoyl)oxy]-9-[(2-methylbutanoyl)oxy]-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxane-2-carboxylate
methyl 6-{[7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-[(2-methylbut-2-enoyl)oxy]-9-[(2-methylbutanoyl)oxy]-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxane-2-carboxylate
(2r,3r,4s,5s,6r)-2-[(2r)-4-[(2s,4ar,4bs,6as,11as,11br)-2-{[(2r,3r,4s,5s,6r)-4-hydroxy-6-(hydroxymethyl)-3,5-bis({[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy})oxan-2-yl]oxy}-4a,6a,7-trimethyl-1h,2h,3h,4h,4bh,5h,6h,11h,11ah,11bh,12h-indeno[2,1-a]phenanthren-8-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(2r,3r,4s,5s,6r)-2-[(2r)-4-[(2s,4ar,4bs,6as,11as,11br)-2-{[(2r,3r,4s,5s,6r)-4-hydroxy-6-(hydroxymethyl)-3,5-bis({[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy})oxan-2-yl]oxy}-4a,6a,7-trimethyl-1h,2h,3h,4h,4bh,5h,6h,11h,11ah,11bh,12h-indeno[2,1-a]phenanthren-8-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(5r,8s,11r,12s,15s,18s,19s,22r)-18-[(1e,3e,5s,6s)-6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid
(5r,8s,11r,12s,15s,18s,19s,22r)-18-[(1e,3e,5s,6s)-6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid
[3-(acetyloxy)-4-{[5-(acetyloxy)-3,4-dimethoxyoxan-2-yl]oxy}-5-({6-[3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl}oxy)oxolan-2-yl]methyl acetate
[3-(acetyloxy)-4-{[5-(acetyloxy)-3,4-dimethoxyoxan-2-yl]oxy}-5-({6-[3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl}oxy)oxolan-2-yl]methyl acetate
(5r,8s,11r,15s,18s,19s,22r)-18-[(1e,3e,5s,6s)-6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid
(5r,8s,11r,15s,18s,19s,22r)-18-[(1e,3e,5s,6s)-6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid
methyl (2s,3s,4s,5r,6r)-6-{[(3s,4s,4ar,6ar,6bs,7r,8s,8ar,9r,10r,12as,14ar,14br)-7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-{[(2z)-2-methylbut-2-enoyl]oxy}-9-{[(2r)-2-methylbutanoyl]oxy}-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxane-2-carboxylate
methyl (2s,3s,4s,5r,6r)-6-{[(3s,4s,4ar,6ar,6bs,7r,8s,8ar,9r,10r,12as,14ar,14br)-7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-{[(2z)-2-methylbut-2-enoyl]oxy}-9-{[(2r)-2-methylbutanoyl]oxy}-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxane-2-carboxylate
methyl (2r,3s,4r,5s,6r)-6-{[(3s,4r,4as,6as,6bs,7s,8r,8ar,9s,10s,12as,14as,14bs)-7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-{[(2z)-2-methylbut-2-enoyl]oxy}-9-{[(2r)-2-methylbutanoyl]oxy}-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxane-2-carboxylate
methyl (2r,3s,4r,5s,6r)-6-{[(3s,4r,4as,6as,6bs,7s,8r,8ar,9s,10s,12as,14as,14bs)-7,8-dihydroxy-8a-(hydroxymethyl)-4-(methoxycarbonyl)-4,6a,6b,11,11,14b-hexamethyl-10-{[(2z)-2-methylbut-2-enoyl]oxy}-9-{[(2r)-2-methylbutanoyl]oxy}-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy}-3,5-dihydroxy-4-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}oxane-2-carboxylate
(2r,3r,4s,5s)-2-{[(3s,6r)-6-[(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl]oxy}-4-(acetyloxy)-5-({[(2s,3r,4s,5r)-4-(acetyloxy)-3,5-dimethoxyoxan-2-yl]oxy}methyl)oxolan-3-yl acetate
(2r,3r,4s,5s)-2-{[(3s,6r)-6-[(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl]oxy}-4-(acetyloxy)-5-({[(2s,3r,4s,5r)-4-(acetyloxy)-3,5-dimethoxyoxan-2-yl]oxy}methyl)oxolan-3-yl acetate
2-[4-(2-{[4-hydroxy-6-(hydroxymethyl)-3,5-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4a,6a,7-trimethyl-1h,2h,3h,4h,4bh,5h,6h,11h,11ah,11bh,12h-indeno[2,1-a]phenanthren-8-yl)-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
2-[4-(2-{[4-hydroxy-6-(hydroxymethyl)-3,5-bis[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-4a,6a,7-trimethyl-1h,2h,3h,4h,4bh,5h,6h,11h,11ah,11bh,12h-indeno[2,1-a]phenanthren-8-yl)-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
[(2s,3s,4r,5r)-5-{[(3s,6r)-6-[(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl]oxy}-3-(acetyloxy)-4-{[(2s,3r,4s,5r)-5-(acetyloxy)-3,4-dimethoxyoxan-2-yl]oxy}oxolan-2-yl]methyl acetate
[(2s,3s,4r,5r)-5-{[(3s,6r)-6-[(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl]oxy}-3-(acetyloxy)-4-{[(2s,3r,4s,5r)-5-(acetyloxy)-3,4-dimethoxyoxan-2-yl]oxy}oxolan-2-yl]methyl acetate
4-(acetyloxy)-5-({[4-(acetyloxy)-3,5-dimethoxyoxan-2-yl]oxy}methyl)-2-({6-[3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl}oxy)oxolan-3-yl acetate
4-(acetyloxy)-5-({[4-(acetyloxy)-3,5-dimethoxyoxan-2-yl]oxy}methyl)-2-({6-[3,3b,5,7-tetrakis(acetyloxy)-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-1-yl]-2-methylheptan-3-yl}oxy)oxolan-3-yl acetate
18-[6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid
18-[6-(acetyloxy)-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-15-(3-carbamimidamidopropyl)-3,6,9,13,16,20-hexahydroxy-5-(hydroxymethyl)-1,12,19-trimethyl-2-methylidene-8-(2-methylpropyl)-25-oxo-1,4,7,10,14,17,21-heptaazacyclopentacosa-3,6,9,13,16,20-hexaene-11,22-dicarboxylic acid