Exact Mass: 708.302814
Exact Mass Matches: 708.302814
Found 104 metabolites which its exact mass value is equals to given mass value 708.302814
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside]
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.
[(2R,3S,4S,5R,6S)-3,4-dihydroxy-6-[4-[3-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-2-methoxyphenoxy]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate
17alpha-digitoxigenin beta-D-glucos-3-ulosyl-(1->4)-alpha-L-thevetoside
1??,2??,6??-Triacetoxy-8??-isobutanoyloxy-9??-(??-furancarbonyloxy)-13-(??-methyl)butanoyloxy-4??-hydroxy-??-dihydroagarofuran
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
Scillipheosidin 3-[glucosyl-(1->2)-rhamnoside]
Bastaxanthin F
2-Dicyclohexylphosphino-2,4,6-triisopropylbiphenyl gold(I) chloride
C33H49AuClP (708.2925813999999)
(R)-2,2,3,3-Tetrahydro-6,6-bis([1,1:3,1-terphenyl]-5-yl)-1,1-spirobi[1H-indene]-7,7-diol,99e.e.
(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-amino-2-(4-hydroxyphenyl)acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-2-(4-hydroxyphenyl)acetyl]amino]-3-hydroxypropanoyl]amino]-2-(4-hydroxyphenyl)acetic acid
ManA4Acbeta1-3FucNAcalpha1-3DFucNAcalpha-O[CH2]3NH2
C29H48N4O16 (708.3065167999999)
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].
(2s,3r,4s,5s,6r)-2-{4-[(1z,3s)-3-(4-{[(2s,3r,4s,5s,6r)-6-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}phenyl)penta-1,4-dien-1-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(1s,4as,6r,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2s,3s,4r,5r,6s)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(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
(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
6-(acetyloxy)-7-[(acetyloxy)methyl]-7-hydroxy-4-({[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}methyl)-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
4-{[(2e)-6-{[(6e)-3-hydroxy-2,6-dimethyl-8-({7-oxofuro[3,2-g]chromen-4-yl}oxy)oct-6-en-2-yl]oxy}-3,7-dimethylocta-2,7-dien-1-yl]oxy}furo[3,2-g]chromen-7-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
14-demethyl-14-isobutyrylanhweidelphinine
{"Ingredient_id": "HBIN001403","Ingredient_name": "14-demethyl-14-isobutyrylanhweidelphinine","Alias": "NA","Ingredient_formula": "C38H48N2O11","Ingredient_Smile": "CC1CC(=O)N(C1=O)C2=CC=CC=C2C(=O)OCC34CCC(C56C3C(C(C5N=C4)(C7(CC(C8CC6C7C8OC(=O)C(C)C)OC)O)O)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5082","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1α,2α,6β-triacetoxy-8β-isobutanoyloxy-9β-(β-furancarbonyloxy)-13-(α-methyl)butanoyloxy-4β-hydroxy-β-dihydroagarofuran
{"Ingredient_id": "HBIN002272","Ingredient_name": "1\u03b1,2\u03b1,6\u03b2-triacetoxy-8\u03b2-isobutanoyloxy-9\u03b2-(\u03b2-furancarbonyloxy)-13-(\u03b1-methyl)butanoyloxy-4\u03b2-hydroxy-\u03b2-dihydroagarofuran","Alias": "NA","Ingredient_formula": "C35H48O15","Ingredient_Smile": "CCC(C)C(=O)OCC12C(C(CC(C13C(C(C(C2OC(=O)C4=COC=C4)OC(=O)C(C)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21510","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
9-[(2r,4r,5r,6r)-4-{[(2s,5s,6s)-5-{[(2s,4r,5s,6r)-4,5-dihydroxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-5-hydroxy-6-methyloxan-2-yl]-1,8-dihydroxy-5-methoxy-3-methyltetraphene-7,12-dione
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
(1s,3s,4s,5r,6r,7r)-1-[(4s,5r)-4-(acetyloxy)-5-methyl-3-methylidene-6-phenylhexyl]-4,7-dihydroxy-6-[(3-hydroxy-4,6-dimethyloctanoyl)oxy]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
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
4,5,12-tris(acetyloxy)-2-hydroxy-2,10,10-trimethyl-6-{[(2-methylbutanoyl)oxy]methyl}-8-[(2-methylpropanoyl)oxy]-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl furan-3-carboxylate
[(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
(2r,3r,5s,7s,8s,9r,10r,13s)-2,7,9,10,13-pentakis(acetyloxy)-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl (2e)-3-phenylprop-2-enoate
(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)
5-hydroxy-2-methyl-6-({3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl}methoxy)-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-3-yl 3-phenylprop-2-enoate
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
(1r,2r,3r,5s,7s,8s,9r,10r,13s)-2,7,9,10,13-pentakis(acetyloxy)-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl (2e)-3-phenylprop-2-enoate
1-[(2s,3r,6r)-10,12-dihydroxy-3-[2,4,6-trihydroxy-3-(3-methylbutanoyl)phenyl]-6-{[2,4,6-trihydroxy-3-(3-methylbutanoyl)phenyl]methyl}-5,7-dioxatricyclo[6.4.0.0²,⁶]dodeca-1(12),8,10-trien-9-yl]-3-methylbutan-1-one
{5-[(acetyloxy)methyl]-16-hydroperoxy-9,21-dihydroxy-23-(1-methoxy-1-oxopropan-2-ylidene)-13,20-dimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-1(24),5-dien-9-yl}methyl 2-methylbut-2-enoate
6-(acetyloxy)-7-[(acetyloxy)methyl]-4-({[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-7-hydroxy-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(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)
(1s,4as,6s,7r,7as)-6-(acetyloxy)-7-[(acetyloxy)methyl]-7-hydroxy-4-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}methyl)-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
9-[4-({5-[(4,5-dihydroxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-5-hydroxy-6-methyloxan-2-yl]-1,8-dihydroxy-5-methoxy-3-methyltetraphene-7,12-dione
3,8-dihydroxy-9-[4-hydroxy-6-methyl-5-({6-methyl-5-[(6-methyl-5-oxooxan-2-yl)oxy]oxan-2-yl}oxy)oxan-2-yl]-5-methoxy-3-methyl-2,4-dihydrotetraphene-1,7,12-trione
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)
1-[4-(acetyloxy)-5-methyl-3-methylidene-6-phenylhexyl]-4,7-dihydroxy-6-[(3-hydroxy-4,6-dimethyloctanoyl)oxy]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
5-hydroxy-2-methyl-6-({3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl}methoxy)-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-3-yl (2e)-3-phenylprop-2-enoate
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
(3r)-3,8-dihydroxy-9-[4-hydroxy-6-methyl-5-({6-methyl-5-[(6-methyl-5-oxooxan-2-yl)oxy]oxan-2-yl}oxy)oxan-2-yl]-5-methoxy-3-methyl-2,4-dihydrotetraphene-1,7,12-trione
[(2r,8r,9s,10s,12r,13s,14s,16s,17s,19r,20s,21r,23z)-5-[(acetyloxy)methyl]-16-hydroperoxy-9,21-dihydroxy-23-(1-methoxy-1-oxopropan-2-ylidene)-13,20-dimethyl-4,22-dioxo-3-oxaoctacyclo[14.7.1.0²,⁶.0²,¹⁴.0⁸,¹³.0¹⁰,¹².0¹⁷,¹⁹.0²⁰,²⁴]tetracosa-1(24),5-dien-9-yl]methyl (2e)-2-methylbut-2-enoate
(1s,2s,4s,5r,6s,7r,8r,9r,12r)-4,5,12-tris(acetyloxy)-2-hydroxy-2,10,10-trimethyl-6-({[(2r)-2-methylbutanoyl]oxy}methyl)-8-[(2-methylpropanoyl)oxy]-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl furan-3-carboxylate
(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
1,4-bis[(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl] (2z)-2-(2-methylpropyl)but-2-enedioate
{8,9-dihydroxy-6,16,18-trimethoxy-4-[(2-methylpropanoyl)oxy]-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadec-11-en-13-yl}methyl 2-(3-methyl-2,5-dioxopyrrolidin-1-yl)benzoate
(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
2-{4-[3-(4-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}phenyl)penta-1,4-dien-1-yl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
[(1s,2r,3r,4s,5r,6s,8r,9s,10s,13s,16s,17r,18s)-8,9-dihydroxy-6,16,18-trimethoxy-4-[(2-methylpropanoyl)oxy]-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadec-11-en-13-yl]methyl 2-[(3s)-3-methyl-2,5-dioxopyrrolidin-1-yl]benzoate
(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)
(1s,3s,8s)-2,7,9,10,13-pentakis(acetyloxy)-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl 3-phenylprop-2-enoate
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
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
C33H44N10O8 (708.3343424000001)