Exact Mass: 824.2797542000001
Exact Mass Matches: 824.2797542000001
Found 72 metabolites which its exact mass value is equals to given mass value 824.2797542000001
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
barbatoside B|wahlenbergioside-3-O-(2-(p-methoxycinnamoyl))-glucoside
3-{[O-6-deoxy-alpha-L-mannopyranosyl-(1->3)-O-2,4-di-O-acetyl-6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyl]oxy}-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one|kaempferol 3-O-[alpha-L-rhamnopyranosyl-(1->3)-2,4-di-O-acetyl-alpha-L-rhamnopyranosyl-(1->6)-]-beta-D-glucopyranoside
(3E,8E)-2alpha,7beta,9,10beta,13alpha,20-hexaacetoxy-5(2-acetoxy-cinnamoyloxy)-3,8-secotaxa-3,8,11-triene
4A-alpha-L-rhodinosyl-3-alpha-L-rhodinosyl-4C->1D-alpha-L-aculosylaquayamycin|saquayamycin K
4-methoxy-5-hydroxy-8-(3-methyl-4-hydroxybut-2-enyl)flavonol 3-O-[alpha-L-rhamnopyranosyl(1->2)-alpha-L-rhamnopyranoside]-7-O-beta-D-glucopyranoside
4A-alpha-L-cinerulosyl-3-alpha-L-rhodinosyl-4C->1D-alpha-L-rhodinosylaquayamycin|saquayamycin J
3-(((2S,3R,4R,5R,6S)-4,5-Dihydroxy-6-methyl-3-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one
beta-D-Araf-(1->2)-alpha-D-Araf-(1->5)-[beta-D-Araf-(1->2)-alpha-D-Araf-(1->3)]-alpha-D-Araf-(1->5)-alpha-D-Araf-OMe
(5z,7r)-3-[(1e)-3-(acetyloxy)prop-1-en-1-yl]-5-[(2e)-3-[(6r,7r)-7-(2,4-dihydroxy-6-methylbenzoyloxy)-6-hydroxy-7-methyl-8-oxo-5,6-dihydro-1h-isochromen-3-yl]prop-2-en-1-ylidene]-7-methyl-6,8-dioxo-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate
(5z,7s)-3-[(1e)-3-(acetyloxy)prop-1-en-1-yl]-5-[(2e)-3-[(6r,7r)-6-(2,4-dihydroxy-6-methylbenzoyloxy)-7-hydroxy-7-methyl-8-oxo-5,6-dihydro-1h-isochromen-3-yl]prop-2-en-1-ylidene]-7-methyl-6,8-dioxo-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate
4-(6-{5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-12-yl}-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)-3-({5-[(5-hydroxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-3-methylbutanoic acid
(2s,3r,4s,5s,6r)-2-{3-hydroxy-5-[(1e)-2-[(2s,3s)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
2-(3,4-dihydroxyphenyl)ethyl (4r,5z,6s)-5-ethylidene-4-{2-[2-(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethoxy]-2-oxoethyl}-6-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
3-[3-(acetyloxy)prop-1-en-1-yl]-5-{3-[6-(2,4-dihydroxy-6-methylbenzoyloxy)-7-hydroxy-7-methyl-8-oxo-5,6-dihydro-1h-isochromen-3-yl]prop-2-en-1-ylidene}-7-methyl-6,8-dioxo-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate
5-{[3-(3,5-dimethoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl]oxy}-3-methyl-5-oxo-3-{[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}pentanoic acid
barbatoside b
{"Ingredient_id": "HBIN017594","Ingredient_name": "barbatoside b","Alias": "NA","Ingredient_formula": "C38H48O20","Ingredient_Smile": "CC(CC(=O)O)(CC(=O)OCC=CC1=CC(=C(C(=C1)OC)OC2C(C(C(C(O2)CO)O)O)O)O)OC3C(C(C(C(O3)CO)O)O)OC(=O)C=CC4=CC=C(C=C4)OC","Ingredient_weight": "824.8 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "19616;21735","PubChem_id": "101718163","DrugBank_id": "NA"}
4a,8,12b-trihydroxy-9-{4-hydroxy-6-methyl-5-[(6-methyl-5-oxooxan-2-yl)oxy]oxan-2-yl}-3-methyl-3-({6-methyl-5-[(6-methyl-5-oxooxan-2-yl)oxy]oxan-2-yl}oxy)-2,4-dihydrotetraphene-1,7,12-trione
5-(acetyloxy)-2-[(6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl)methoxy]-6-methyl-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl acetate
(3s)-4-{6-[(1r,3r,5s,8s,10r,12r,14r)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-12-yl]-1,5-dihydroxy-9,10-dioxoanthracen-2-yl}-3-{[(2s,5r,6s)-5-{[(2s,5r,6s)-5-hydroxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-3-methylbutanoic acid
1-{[(3e,5e,7r,8s,12s,13s,14e,16s)-19-[(2s,3s,4s,5r,6s)-6-[(acetyloxy)methyl]-3,4-dihydroxy-5-(c-hydroxycarbonimidoyloxy)oxan-2-yl]-21-chloro-8,10,22-trihydroxy-7-methoxy-3,13,15-trimethyl-18-oxo-11-oxa-9,19-diazatricyclo[18.3.1.1⁸,¹²]pentacosa-1(23),3,5,9,14,20(24),21-heptaen-16-yl]oxy}-n-methylmethanimidic acid
3-{[(2s,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
(5z)-3-[(1e)-3-(acetyloxy)prop-1-en-1-yl]-5-[(2e)-3-[(6r,7r)-7-(2,4-dihydroxy-6-methylbenzoyloxy)-6-hydroxy-7-methyl-8-oxo-5,6-dihydro-1h-isochromen-3-yl]prop-2-en-1-ylidene]-7-methyl-6,8-dioxo-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate
(2e)-3-(3-hydroxy-5-methoxy-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl (3s)-3-(acetyloxy)-3-{[(2r,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2e)-3-(4-methoxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}butanoate
3-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
(11r,16s)-13-{2-[2,4-dihydroxy-5-(3-methylbut-2-en-1-yl)phenyl]-5-hydroxy-7,7-dimethylfuro[2,3-f]chromene-3-carbonyl}-5,14-dihydroxy-4,15-bis(3-methylbut-2-en-1-yl)-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2,4,6,12,14-hexaen-9-one
3-[(4,5-dihydroxy-6-methyl-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
(2r,3r,4r,5s,6s)-5-(acetyloxy)-2-{[(2r,3s,4s,5r,6s)-6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyl-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl acetate
(3s)-5-{[(2e)-3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl]oxy}-3-methyl-5-oxo-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}pentanoic acid
4a,8,12b-trihydroxy-9-{4-hydroxy-5-[(5-hydroxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}-3-methyl-3-({6-methyl-5-[(6-methyl-5-oxo-2,6-dihydropyran-2-yl)oxy]oxan-2-yl}oxy)-2,4-dihydrotetraphene-1,7,12-trione
(3r,4ar,12bs)-9-[(1r,3r,5s,8s,10r,12r,14r)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-12-yl]-4a,8,12b-trihydroxy-3-{[(2s,5s,6s)-5-{[(2s,5s,6s)-5-hydroxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-3-methyl-2,4-dihydrotetraphene-1,7,12-trione
2-(3,4-dihydroxyphenyl)ethyl (5z,6s)-5-ethylidene-4-{2-[2-(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethoxy]-2-oxoethyl}-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
(2s,3r,4s,5s,6r)-2-{3-hydroxy-5-[(1e)-2-[(2r,3r)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-{3-hydroxy-5-[(1e)-2-[(2r,3r)-7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(3-hydroxy-5-{[(2s,3r,4s,5s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1-benzofuran-5-yl]ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(3s)-5-{[(2e)-3-(3,5-dimethoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl]oxy}-3-methyl-5-oxo-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}pentanoic acid
2-(3-hydroxy-5-{2-[3-(4-hydroxy-3-methoxyphenyl)-2-(3-hydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]ethenyl}phenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,2s,3e,5s,7r,8e,10r,13s)-2,7,9,10,13-pentakis(acetyloxy)-4-[(acetyloxy)methyl]-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,8,11-trien-5-yl (2z)-2-(acetyloxy)-3-phenylprop-2-enoate
(3s)-3-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2e)-3-(4-methoxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}-5-{[(2e)-3-(3-hydroxy-5-methoxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl]oxy}-3-methyl-5-oxopentanoic acid
3-{[(2r,3r,4r,5r,6s)-4,5-dihydroxy-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
3-{[4,5-dihydroxy-6-(hydroxymethyl)-3-{[3-(4-methoxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}-5-{[3-(3-hydroxy-5-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-en-1-yl]oxy}-3-methyl-5-oxopentanoic acid
(2s,3r,4s,5s,6r)-2-{3-hydroxy-5-[(1e)-2-[(2s,3s)-3-(4-hydroxy-3-methoxyphenyl)-2-(3-hydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-2,3-dihydro-1,4-benzodioxin-6-yl]ethenyl]phenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(3r,4ar,12bs)-4a,8,12b-trihydroxy-9-[(2r,4r,5s,6r)-4-hydroxy-5-{[(2s,5s,6s)-5-hydroxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]-3-methyl-3-{[(2s,5s,6s)-6-methyl-5-{[(2r,6s)-6-methyl-5-oxo-2,6-dihydropyran-2-yl]oxy}oxan-2-yl]oxy}-2,4-dihydrotetraphene-1,7,12-trione
2,7,9,10,13-pentakis(acetyloxy)-4-[(acetyloxy)methyl]-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,8,11-trien-5-yl 2-(acetyloxy)-3-phenylprop-2-enoate
2-(3,4-dihydroxyphenyl)ethyl 5-ethylidene-4-{2-[2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)ethoxy]-2-oxoethyl}-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate
9-{5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.0³,⁸]tetradecan-12-yl}-4a,8,12b-trihydroxy-3-({5-[(5-hydroxy-6-methyloxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-3-methyl-2,4-dihydrotetraphene-1,7,12-trione
(4s,7s,13r,22r)-2,5,8,11,14,20-hexahydroxy-4-(1h-indol-3-ylmethyl)-7-[(4-methoxy-1h-indol-3-yl)methyl]-13,18,22-trimethyl-16-methylidene-24-thia-3,6,9,12,15,18,21,26-octaazabicyclo[21.2.1]hexacosa-1(25),2,5,8,11,14,20,23(26)-octaen-17-one
C40H44N10O8S (824.3064144000001)
3-{[(2s,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}-5-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
3-[3-(acetyloxy)prop-1-en-1-yl]-5-{3-[7-(2,4-dihydroxy-6-methylbenzoyloxy)-6-hydroxy-7-methyl-8-oxo-5,6-dihydro-1h-isochromen-3-yl]prop-2-en-1-ylidene}-7-methyl-6,8-dioxo-1h-isochromen-7-yl 2,4-dihydroxy-6-methylbenzoate
(11r,16s)-13-[5,6-dihydroxy-2-(7-hydroxy-2,2-dimethylchromen-6-yl)-7-(3-methylbut-2-en-1-yl)-1-benzofuran-3-carbonyl]-5,14-dihydroxy-4,15-bis(3-methylbut-2-en-1-yl)-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-1(10),2,4,6,12,14-hexaen-9-one
2,5,8,11,14,20-hexahydroxy-4-(1h-indol-3-ylmethyl)-7-[(5-methoxy-1h-indol-3-yl)methyl]-13,18,22-trimethyl-16-methylidene-24-thia-3,6,9,12,15,18,21,26-octaazabicyclo[21.2.1]hexacosa-1(25),2,5,8,11,14,20,23(26)-octaen-17-one
C40H44N10O8S (824.3064144000001)