Exact Mass: 708.3442378
Exact Mass Matches: 708.3442378
Found 45 metabolites which its exact mass value is equals to given mass value 708.3442378,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside]
5-{5-[(4,5-dihydroxy-6-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-11,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-14-yl}-2H-pyran-2-one
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside] is found in fruits. Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside] is a constituent of the seeds of Tamarindus indica (tamarind). Constituent of the seeds of Tamarindus indica (tamarind). Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside] is found in fruits.
17alpha-digitoxigenin beta-D-glucos-3-ulosyl-(1->4)-alpha-L-thevetoside
17alpha-digitoxigenin beta-D-glucos-3-ulosyl-(1->4)-alpha-L-thevetoside
scillarenin-3-O-beta-D-glucosido-(1-4)-beta-D-glucoside
scillarenin-3-O-beta-D-glucosido-(1-4)-beta-D-glucoside
3beta-(O4-beta-D-Glucopyranosyl-alpha-L-rhamnopyranosyloxy)-12beta,14-dihydroxy-14beta-bufa-4,20,22-trienolid|3beta-(O4-beta-D-glucopyranosyl-alpha-L-rhamnopyranosyloxy)-12beta,14-dihydroxy-14beta-bufa-4,20,22-trienolide|glucoscilliphaeoside
3beta-(O4-beta-D-Glucopyranosyl-alpha-L-rhamnopyranosyloxy)-12beta,14-dihydroxy-14beta-bufa-4,20,22-trienolid|3beta-(O4-beta-D-glucopyranosyl-alpha-L-rhamnopyranosyloxy)-12beta,14-dihydroxy-14beta-bufa-4,20,22-trienolide|glucoscilliphaeoside
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside]
5-{5-[(4,5-dihydroxy-6-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-11,16-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-14-yl}-2H-pyran-2-one
BIO-1211
BIO-1211
BIO-1211 is a highly selective and orally active α4β1 (VLA-4) inhibitor, with IC50 values of 4 nM and 2 μM for α4β1 and α4β7, respectively[1][2][3].
(1s,4ar,7s,7as)-1-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-3-{[(2e,6e)-8-hydroxy-2,6-dimethylocta-2,6-dienoyl]oxy}-6-(hydroxymethyl)oxan-2-yl]oxy}-4-formyl-4a-hydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2e,6e)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
(1s,4ar,7s,7as)-1-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-3-{[(2e,6e)-8-hydroxy-2,6-dimethylocta-2,6-dienoyl]oxy}-6-(hydroxymethyl)oxan-2-yl]oxy}-4-formyl-4a-hydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl (2e,6e)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
(1s,2s,3r,4s,7r,9s,10s,11s,12r,15s)-4,9,11,12,15-pentakis(acetyloxy)-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl hexanoate
(1s,2s,3r,4s,7r,9s,10s,11s,12r,15s)-4,9,11,12,15-pentakis(acetyloxy)-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl hexanoate
(1r,2s,3r,4s,7r,9s,10s,11r,12r,15s)-4,9,11,12,15-pentakis(acetyloxy)-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl hexanoate
(1r,2s,3r,4s,7r,9s,10s,11r,12r,15s)-4,9,11,12,15-pentakis(acetyloxy)-1-hydroxy-10,14,17,17-tetramethyl-6-oxatetracyclo[11.3.1.0³,¹⁰.0⁴,⁷]heptadec-13-en-2-yl hexanoate
(1r,2r,3ar,5r,9s,10r,11s,13r,13as)-1,3a,9,10,13-pentakis(acetyloxy)-2,5,8,8-tetramethyl-12-methylidene-11-(2-methylpropoxy)-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl acetate
(1r,2r,3ar,5r,9s,10r,11s,13r,13as)-1,3a,9,10,13-pentakis(acetyloxy)-2,5,8,8-tetramethyl-12-methylidene-11-(2-methylpropoxy)-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl acetate
5-[(1r,3as,3br,7s,9ar,9bs,11r,11as)-7-{[(2r,3r,4s,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11r,11as)-7-{[(2r,3r,4s,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11ar)-7-{[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11ar)-7-{[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11ar)-7-{[(2s,3r,4s,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11ar)-7-{[(2s,3r,4s,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
[(1s,2s,3s,4r,7s,8e,10z,12s,13r,14s,16r,17s)-2,12,14,16-tetrakis(acetyloxy)-3,17-dihydroxy-4,13,17-trimethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,10-dien-9-yl]methyl octanoate
[(1s,2s,3s,4r,7s,8e,10z,12s,13r,14s,16r,17s)-2,12,14,16-tetrakis(acetyloxy)-3,17-dihydroxy-4,13,17-trimethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,10-dien-9-yl]methyl octanoate
5-(7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl)pyran-2-one
5-(7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a-hydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl)pyran-2-one
(2s)-2-[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-2-[({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-c-hydroxycarbonimidoyl]-5-oxopyrrolidin-1-yl]-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
(2s)-2-[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-2-[({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-c-hydroxycarbonimidoyl]-5-oxopyrrolidin-1-yl]-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
C33H44N10O8 (708.3343424000001)
7'-(acetyloxy)-3',4,4'-trihydroxy-7-methoxy-2,3',5a,6,6',9',9b-heptamethyl-8,10'-dioxo-2,3a,4,5,9,9a-hexahydro-1h-11'-oxaspiro[cyclopenta[a]naphthalene-3,2'-tricyclo[7.2.1.0¹,⁶]dodecan]-5'-yl benzoate
7'-(acetyloxy)-3',4,4'-trihydroxy-7-methoxy-2,3',5a,6,6',9',9b-heptamethyl-8,10'-dioxo-2,3a,4,5,9,9a-hexahydro-1h-11'-oxaspiro[cyclopenta[a]naphthalene-3,2'-tricyclo[7.2.1.0¹,⁶]dodecan]-5'-yl benzoate
(2s)-2-({[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-1-({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-5-oxopyrrolidin-2-yl](hydroxy)methylidene}amino)-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
(2s)-2-({[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-1-({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-5-oxopyrrolidin-2-yl](hydroxy)methylidene}amino)-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
C33H44N10O8 (708.3343424000001)
n-{2-[16-(3-carbamimidamidopropyl)-3,10,13,14,16-pentahydroxy-6,7-bis(4-hydroxyphenyl)-11-methyl-17-oxo-1,4,9,12-tetraazatricyclo[12.3.0.0⁵,⁸]heptadeca-3,9,12-trien-15-yl]ethyl}guanidine
n-{2-[16-(3-carbamimidamidopropyl)-3,10,13,14,16-pentahydroxy-6,7-bis(4-hydroxyphenyl)-11-methyl-17-oxo-1,4,9,12-tetraazatricyclo[12.3.0.0⁵,⁸]heptadeca-3,9,12-trien-15-yl]ethyl}guanidine
C33H44N10O8 (708.3343424000001)
6-(but-2-en-2-yl)-3,21',24'-trihydroxy-5,11',13'-trimethyl-2'-oxo-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-22'-ylmethyl 2-(furan-3-yl)acetate
6-(but-2-en-2-yl)-3,21',24'-trihydroxy-5,11',13'-trimethyl-2'-oxo-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-22'-ylmethyl 2-(furan-3-yl)acetate
(2e,4e)-6-hydroxy-n-[(1s)-1-{[(3s,7s,9r,13s,16s,19s)-15-hydroxy-9,13,16,17-tetramethyl-2,6,12,18-tetraoxo-5-oxa-1,11,14,17-tetraazatricyclo[17.3.0.0⁷,¹¹]docos-14-en-3-yl]-c-hydroxycarbonimidoyl}-2-phenylethyl]hexa-2,4-dienimidic acid
(2e,4e)-6-hydroxy-n-[(1s)-1-{[(3s,7s,9r,13s,16s,19s)-15-hydroxy-9,13,16,17-tetramethyl-2,6,12,18-tetraoxo-5-oxa-1,11,14,17-tetraazatricyclo[17.3.0.0⁷,¹¹]docos-14-en-3-yl]-c-hydroxycarbonimidoyl}-2-phenylethyl]hexa-2,4-dienimidic acid
5-[(1r,3as,3br,7s,9ar,9bs,11r,11as)-7-{[(2r,3r,4r,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
5-[(1r,3as,3br,7s,9ar,9bs,11r,11as)-7-{[(2r,3r,4r,5r,6s)-3,4-dihydroxy-6-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]pyran-2-one
(1'r,2s,3r,4's,5s,6s,8'r,10'e,13'r,14'e,16'e,21'r,24's)-6-[(2e)-but-2-en-2-yl]-3,21',24'-trihydroxy-5,11',13'-trimethyl-2'-oxo-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-22'-ylmethyl 2-(furan-3-yl)acetate
(1'r,2s,3r,4's,5s,6s,8'r,10'e,13'r,14'e,16'e,21'r,24's)-6-[(2e)-but-2-en-2-yl]-3,21',24'-trihydroxy-5,11',13'-trimethyl-2'-oxo-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraen-22'-ylmethyl 2-(furan-3-yl)acetate
(2r)-2-({[(2r,3s,4r)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-1-({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-5-oxopyrrolidin-2-yl](hydroxy)methylidene}amino)-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
(2r)-2-({[(2r,3s,4r)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-1-({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-5-oxopyrrolidin-2-yl](hydroxy)methylidene}amino)-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
C33H44N10O8 (708.3343424000001)
5-{7-[(3,4-dihydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}pyran-2-one
5-{7-[(3,4-dihydroxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-3a,11-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,5h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}pyran-2-one
(2r)-2-[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-2-[({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-c-hydroxycarbonimidoyl]-5-oxopyrrolidin-1-yl]-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
(2r)-2-[(2s,3r,4s)-3-(2-carbamimidamidoethyl)-4-(3-carbamimidamidopropyl)-2,4-dihydroxy-2-[({[(1e)-2-(4-hydroxyphenyl)ethenyl]-c-hydroxycarbonimidoyl}methyl)-c-hydroxycarbonimidoyl]-5-oxopyrrolidin-1-yl]-n-[(1e)-2-(4-hydroxyphenyl)ethenyl]propanimidic acid
C33H44N10O8 (708.3343424000001)
n-{2-[(1r,6r,7r,8s,9s,15s,16s,17s)-17-(3-carbamimidamidopropyl)-4,11,14,15,17-pentahydroxy-7,8-bis(4-hydroxyphenyl)-18-oxo-2,5,10,13-tetraazatricyclo[13.3.0.0⁶,⁹]octadeca-4,10,13-trien-16-yl]ethyl}guanidine
n-{2-[(1r,6r,7r,8s,9s,15s,16s,17s)-17-(3-carbamimidamidopropyl)-4,11,14,15,17-pentahydroxy-7,8-bis(4-hydroxyphenyl)-18-oxo-2,5,10,13-tetraazatricyclo[13.3.0.0⁶,⁹]octadeca-4,10,13-trien-16-yl]ethyl}guanidine
C33H44N10O8 (708.3343424000001)
1-({4,5-dihydroxy-3-[(8-hydroxy-2,6-dimethylocta-2,6-dienoyl)oxy]-6-(hydroxymethyl)oxan-2-yl}oxy)-4-formyl-4a-hydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl 8-hydroxy-2,6-dimethylocta-2,6-dienoate
1-({4,5-dihydroxy-3-[(8-hydroxy-2,6-dimethylocta-2,6-dienoyl)oxy]-6-(hydroxymethyl)oxan-2-yl}oxy)-4-formyl-4a-hydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl 8-hydroxy-2,6-dimethylocta-2,6-dienoate
(1'r,2s,3s,3'r,3ar,4r,4'r,5'r,5as,6'r,7's,9'r,9as,9bs)-7'-(acetyloxy)-3',4,4'-trihydroxy-7-methoxy-2,3',5a,6,6',9',9b-heptamethyl-8,10'-dioxo-2,3a,4,5,9,9a-hexahydro-1h-11'-oxaspiro[cyclopenta[a]naphthalene-3,2'-tricyclo[7.2.1.0¹,⁶]dodecan]-5'-yl benzoate
(1'r,2s,3s,3'r,3ar,4r,4'r,5'r,5as,6'r,7's,9'r,9as,9bs)-7'-(acetyloxy)-3',4,4'-trihydroxy-7-methoxy-2,3',5a,6,6',9',9b-heptamethyl-8,10'-dioxo-2,3a,4,5,9,9a-hexahydro-1h-11'-oxaspiro[cyclopenta[a]naphthalene-3,2'-tricyclo[7.2.1.0¹,⁶]dodecan]-5'-yl benzoate