Chemical Formula: C40H44O13

Chemical Formula C40H44O13

Found 30 metabolite its formula value is C40H44O13

Arctignan D

(3R,4R)-4-[[3-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl]oxolan-2-one

C40H44O13 (732.2781774)


Arctignan d is a member of the class of compounds known as 2-arylbenzofuran flavonoids. 2-arylbenzofuran flavonoids are phenylpropanoids containing the 2-phenylbenzofuran moiety. Arctignan d is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctignan d can be found in burdock, which makes arctignan d a potential biomarker for the consumption of this food product.

   

Arctignan E

(3R,4R)-3-[[3-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-4-[[(2S,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl]oxolan-2-one

C40H44O13 (732.2781774)


Arctignan e is a member of the class of compounds known as 2-arylbenzofuran flavonoids. 2-arylbenzofuran flavonoids are phenylpropanoids containing the 2-phenylbenzofuran moiety. Arctignan e is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctignan e can be found in burdock, which makes arctignan e a potential biomarker for the consumption of this food product.

   

Shizukaol F

Shizukaol F

C40H44O13 (732.2781774)


A natural product found in Chloranthus japonicus.

   

shizukaol B

methyl (2Z)-2-[(1S,13E,18S,19S,21R,22S,23S,26S,28R,29S,30R,33R,36R)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.125,29.01,23.04,34.019,21.022,36.026,28.033,37]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


Shizukaol B is a triterpenoid. It has a role as a metabolite. shizukaol B is a natural product found in Chloranthus spicatus, Chloranthus fortunei, and other organisms with data available. A natural product found in Chloranthus japonicus.

   
   
   
   
   

Euphorbiaproliferin E

Euphorbiaproliferin E

C40H44O13 (732.2781774)


A natural product found in Euphorbia prolifera.

   

methyl 2-[(1s,13e,18s,19r,21s,22r,23s,26s,28r,29r,30s,32z,33r,36r)-18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

methyl 2-[(1s,13e,18s,19r,21s,22r,23s,26s,28r,29r,30s,32z,33r,36r)-18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


   

methyl 2-{18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene}propanoate

methyl 2-{18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene}propanoate

C40H44O13 (732.2781774)


   

methyl 2-[(13e,18s,19s,21r,22r,23s,26s,28r,30r,32z,33s,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,9,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

methyl 2-[(13e,18s,19s,21r,22r,23s,26s,28r,30r,32z,33s,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,9,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


   

methyl 2-[(1s,13e,18s,19r,21s,22r,23s,26s,28r,29r,30s,32e,33r,36r)-18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

methyl 2-[(1s,13e,18s,19r,21s,22r,23s,26s,28r,29r,30s,32e,33r,36r)-18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


   

(3r,4r)-3-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-3-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

arctignan d

NA

C40H44O13 (732.2781774)


{"Ingredient_id": "HBIN016615","Ingredient_name": "arctignan d","Alias": "NA","Ingredient_formula": "C40H44O13","Ingredient_Smile": "COC1=CC(=CC(=C1O)C(CO)C(C2=CC(=C(C=C2)O)OC)O)CC3COC(=O)C3CC4=CC5=C(C(=C4)OC)OC(C5CO)C6=CC(=C(C=C6)O)OC","Ingredient_weight": "732.77","OB_score": "NA","CAS_id": "155661-11-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6703","PubChem_id": "73425493","DrugBank_id": "NA"}

   

Arctignan E

arctignan e

C40H44O13 (732.2781774)


{"Ingredient_id": "HBIN016616","Ingredient_name": "Arctignan E","Alias": "arctignan e","Ingredient_formula": "C40H44O13","Ingredient_Smile": "COC1=CC(=CC(=C1O)C(CO)C(C2=CC(=C(C=C2)O)OC)O)CC3C(COC3=O)CC4=CC5=C(C(=C4)OC)OC(C5CO)C6=CC(=C(C=C6)O)OC","Ingredient_weight": "732.77","OB_score": "3.772289372","CAS_id": "155661-12-4","SymMap_id": "SMIT11840","TCMID_id": "NA","TCMSP_id": "MOL010866","TCM_ID_id": "6702","PubChem_id": "73425494","DrugBank_id": "NA"}

   

arctignan g

NA

C40H44O13 (732.2781774)


{"Ingredient_id": "HBIN016618","Ingredient_name": "arctignan g","Alias": "NA","Ingredient_formula": "C40H44O13","Ingredient_Smile": "COC1=CC(=CC2=C1OC(C2CO)C3=CC(=C(C=C3)O)OC)CC4COC(=O)C4CC5=CC(=C(C=C5)OC(CO)C(C6=CC(=C(C=C6)O)OC)O)OC","Ingredient_weight": "732.77","OB_score": "NA","CAS_id": "186541-89-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6700","PubChem_id": "10771247","DrugBank_id": "NA"}

   

methyl 2-{18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene}propanoate

methyl 2-{18,30-dihydroxy-13,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene}propanoate

C40H44O13 (732.2781774)


   

methyl 2-[(1r,13e,18s,19s,21r,22r,23s,26s,28r,29s,30r,32z,33s,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,9,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

methyl 2-[(1r,13e,18s,19s,21r,22r,23s,26s,28r,29s,30r,32z,33s,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,9,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


   

(3r,4r)-4-[(4-{[(1r,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-4-[(4-{[(1r,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

(3r,4r)-4-({3-[(1s,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-4-({3-[(1s,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

(3r,4r)-3-[(4-{[(1r,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-3-[(4-{[(1r,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

(3r,4r)-3-({3-[(1s,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-3-({3-[(1s,2s)-1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-4-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

(2r,3r,3as,4r,6s,7r,12s,13ar)-3,7,13a-tris(acetyloxy)-4-(benzoyloxy)-2-hydroxy-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-6-yl benzoate

(2r,3r,3as,4r,6s,7r,12s,13ar)-3,7,13a-tris(acetyloxy)-4-(benzoyloxy)-2-hydroxy-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-6-yl benzoate

C40H44O13 (732.2781774)


   

4-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

4-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

3,7,13a-tris(acetyloxy)-4-(benzoyloxy)-2-hydroxy-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-6-yl benzoate

3,7,13a-tris(acetyloxy)-4-(benzoyloxy)-2-hydroxy-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-6-yl benzoate

C40H44O13 (732.2781774)


   

methyl 2-[(1s,13e,18s,19s,21r,22s,23s,26s,28r,29s,30r,32e,33r,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

methyl 2-[(1s,13e,18s,19s,21r,22s,23s,26s,28r,29s,30r,32e,33r,36r)-18,30-dihydroxy-14,22,29-trimethyl-3,7,10,15,31-pentaoxo-2,6,11,16-tetraoxanonacyclo[16.15.3.1²⁵,²⁹.0¹,²³.0⁴,³⁴.0¹⁹,²¹.0²²,³⁶.0²⁶,²⁸.0³³,³⁷]heptatriaconta-4(34),13,25(37)-trien-32-ylidene]propanoate

C40H44O13 (732.2781774)


   

(3r,4r)-4-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

(3r,4r)-4-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-{[(2s,3r)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)


   

3-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

3-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-4-{[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]methyl}oxolan-2-one

C40H44O13 (732.2781774)