Exact Mass: 556.1945
Exact Mass Matches: 556.1945
Found 44 metabolites which its exact mass value is equals to given mass value 556.1945,
within given mass tolerance error 0.001 dalton. Try search metabolite list with more accurate mass tolerance error
0.0002 dalton.
Aloeresin D
[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[2-[(2R)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl]oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
Aloeresin D is a natural product found in Aloe africana, Aloe ferox, and other organisms with data available. Aloeresin D is a chromone glycoside isolated from Aloe vera, inhibits β-Secretase (BACE1) activity, with an IC50 of 39 μM[1]. Aloeresin D is a chromone glycoside isolated from Aloe vera, inhibits β-Secretase (BACE1) activity, with an IC50 of 39 μM[1].
8-C-Glucosyl-(2-O-cinnamoyl)-7-O-methylaloediol A
(-)-8-C-Glucosyl-(2-O-cinnamoyl)-7-O-methylaloediol A
8-C-Glucosyl-(2-O-cinnamoyl)-7-O-methylaloediol B
(-)-8-C-Glucosyl-(2-O-cinnamoyl)-7-O-methylaloediol B
(-)-(7R,8S,7S,8R)-3,3,5,5-tetramethoxy-4-hydroxy-4,7-epoxy-8,9-dinor-4,8-oxy-8,3-sesquineolignan-7,9,9-triol-7-al
(-)-(7R,8S,7S,8R)-3,3,5,5-tetramethoxy-4-hydroxy-4,7-epoxy-8,9-dinor-4,8-oxy-8,3-sesquineolignan-7,9,9-triol-7-al
A neolignan isolated from the stems of Sinocalamus affinis.
3-{4-[2-({4-[2-({4-[(1e)-but-1-en-1-yl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}propanoic acid
3-{4-[2-({4-[2-({4-[(1e)-but-1-en-1-yl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}propanoic acid
(1r,3r,7r,12r,14r,15r,16s,17r,20z,22e,24r,25s,28r)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(1r,3r,7r,12r,14r,15r,16s,17r,20z,22e,24r,25s,28r)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(1s,2s,3r,5r,7r,8r,9s,12r,13r)-3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
(1s,2s,3r,5r,7r,8r,9s,12r,13r)-3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
methyl (2z)-3-[(1r,2r,4s,7s,8s,10r,12r)-10-(acetyloxy)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,13,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate
methyl (2z)-3-[(1r,2r,4s,7s,8s,10r,12r)-10-(acetyloxy)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,13,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate
2''-o-cinnamoyl-8-c-glucosyl-7-o-methylaloediol a
NA
{"Ingredient_id": "HBIN006212","Ingredient_name": "2''-o-cinnamoyl-8-c-glucosyl-7-o-methylaloediol a","Alias": "NA","Ingredient_formula": "C29H32O11","Ingredient_Smile": "NA","Ingredient_weight": "556.565","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8543","PubChem_id": "NA","DrugBank_id": "NA"}
2''-o-cinnamoyl-8-c-glucosyl-7-o-methylaloediol b
NA
{"Ingredient_id": "HBIN006213","Ingredient_name": "2''-o-cinnamoyl-8-c-glucosyl-7-o-methylaloediol b","Alias": "NA","Ingredient_formula": "C29H32O11","Ingredient_Smile": "NA","Ingredient_weight": "556.565","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8542","PubChem_id": "NA","DrugBank_id": "NA"}
aloesinol; (2'r)-form,1'-hydroxy,7-me ether,2''-o-cinnamoyl(e-)
NA
{"Ingredient_id": "HBIN015307","Ingredient_name": "aloesinol; (2'r)-form,1'-hydroxy,7-me ether,2''-o-cinnamoyl(e-)","Alias": "NA","Ingredient_formula": "C29H32O11","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6993","PubChem_id": "NA","DrugBank_id": "NA"}
aloesinol; (2'r)-form,1'-hydroxy,7-me ether,2''-o-cinnamoyl(e-),stereoisomer
NA
{"Ingredient_id": "HBIN015308","Ingredient_name": "aloesinol; (2'r)-form,1'-hydroxy,7-me ether,2''-o-cinnamoyl(e-),stereoisomer","Alias": "NA","Ingredient_formula": "C29H32O11","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6992","PubChem_id": "NA","DrugBank_id": "NA"}
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2r)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2r)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
(1s,12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl (2z)-2-methylbut-2-enoate
(1s,12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl (2z)-2-methylbut-2-enoate
3-[4-(2-{[4-(2-{[4-(but-1-en-1-yl)-2,5-dioxofuran-3-yl]methyl}butyl)-2,5-dioxofuran-3-yl]methyl}butyl)-2,5-dioxofuran-3-yl]propanoic acid
3-[4-(2-{[4-(2-{[4-(but-1-en-1-yl)-2,5-dioxofuran-3-yl]methyl}butyl)-2,5-dioxofuran-3-yl]methyl}butyl)-2,5-dioxofuran-3-yl]propanoic acid
(1r,2r,3s,5s,7s,8s,9r,12s,13s)-3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
(1r,2r,3s,5s,7s,8s,9r,12s,13s)-3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl 2-methylbut-2-enoate
12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl 2-methylbut-2-enoate
(12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl (2z)-2-methylbut-2-enoate
(12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-18,19-dimethoxy-13,14-dimethyl-20-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,18-pentaen-15-yl (2z)-2-methylbut-2-enoate
(1r,7r,12r,16s,17r,20z,22e,24r,28r)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(1r,7r,12r,16s,17r,20z,22e,24r,28r)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(2-hydroxypropyl)-7-methoxy-5-methyl-4-oxochromen-8-yl]oxan-3-yl 3-(4-hydroxyphenyl)prop-2-enoate
4,5-dihydroxy-6-(hydroxymethyl)-2-[2-(2-hydroxypropyl)-7-methoxy-5-methyl-4-oxochromen-8-yl]oxan-3-yl 3-(4-hydroxyphenyl)prop-2-enoate
2-[2-(1,2-dihydroxypropyl)-7-methoxy-5-methyl-4-oxochromen-8-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl 3-phenylprop-2-enoate
2-[2-(1,2-dihydroxypropyl)-7-methoxy-5-methyl-4-oxochromen-8-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl 3-phenylprop-2-enoate
[3,4,5-trihydroxy-6-({6-methyl-3-methylidene-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-9-yl}methoxy)oxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate
[3,4,5-trihydroxy-6-({6-methyl-3-methylidene-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-9-yl}methoxy)oxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate
[(2r,3s,4s,5r,6r)-6-{[(3as,9as,9bs)-6-methyl-3-methylidene-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-9-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate
[(2r,3s,4s,5r,6r)-6-{[(3as,9as,9bs)-6-methyl-3-methylidene-2,7-dioxo-3ah,4h,5h,9ah,9bh-azuleno[4,5-b]furan-9-yl]methoxy}-3,4,5-trihydroxyoxan-2-yl]methyl 2-(4-hydroxyphenyl)acetate
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2r)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2r)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
methyl 3-[10-(acetyloxy)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,13,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate
methyl 3-[10-(acetyloxy)-7-(furan-3-yl)-1,8,15,15-tetramethyl-5,13,18-trioxo-3,6,14-trioxapentacyclo[9.7.0.0²,⁴.0²,⁸.0¹²,¹⁶]octadecan-12-yl]prop-2-enoate
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2s)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-{2-[(2s)-2-hydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}oxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
(22e)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(22e)-25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(2s,3r,4s,5s,6r)-2-{2-[(1r,2s)-1,2-dihydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl (2e)-3-phenylprop-2-enoate
(2s,3r,4s,5s,6r)-2-{2-[(1r,2s)-1,2-dihydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl (2e)-3-phenylprop-2-enoate
(1s,12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,19-pentaen-15-yl (2z)-2-methylbut-2-enoate
(1s,12r,13s,14s,15s)-12-(acetyloxy)-14-hydroxy-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,19-pentaen-15-yl (2z)-2-methylbut-2-enoate
3-{4-[(2r)-2-({4-[(2r)-2-({4-[(1e)-but-1-en-1-yl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}propanoic acid
3-{4-[(2r)-2-({4-[(2r)-2-({4-[(1e)-but-1-en-1-yl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}methyl)butyl]-2,5-dioxofuran-3-yl}propanoic acid
3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
3-(acetyloxy)-2,2',2',9,13-pentamethyl-6,16-dimethylidene-6',11,15-trioxo-10,14,17-trioxaspiro[pentacyclo[7.6.1.1⁷,¹².0¹,¹².0²,⁷]heptadecane-5,3'-pyran]-8-yl acetate
25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
25-hydroxy-10,16-dimethyl-2,5,13,18,27,31-hexaoxaspiro[heptacyclo[22.4.3.1¹⁴,¹⁷.0¹,³.0⁷,¹².0⁷,¹⁶.0²⁴,²⁸]dotriacontane-15,2'-oxirane]-10,20,22-triene-4,19,26-trione
(2s,3r,4s,5s,6r)-2-{2-[(1s,2s)-1,2-dihydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl (2e)-3-phenylprop-2-enoate
(2s,3r,4s,5s,6r)-2-{2-[(1s,2s)-1,2-dihydroxypropyl]-7-methoxy-5-methyl-4-oxochromen-8-yl}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl (2e)-3-phenylprop-2-enoate
(2r,3s)-2-(4-{[(1s,2r)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carbaldehyde
(2r,3s)-2-(4-{[(1s,2r)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-carbaldehyde
12-(acetyloxy)-14-hydroxy-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,19-pentaen-15-yl 2-methylbut-2-enoate
12-(acetyloxy)-14-hydroxy-19,20-dimethoxy-13,14-dimethyl-18-oxo-3,6,8-trioxapentacyclo[9.9.1.0¹,¹⁶.0⁴,²¹.0⁵,⁹]henicosa-4,9,11(21),16,19-pentaen-15-yl 2-methylbut-2-enoate
