Chemical Formula: C28H32O9
Chemical Formula C28H32O9
Found 49 metabolite its formula value is C28H32O9
Physalin M
(1S,2S,3R,5R,6R,14R,15S,18R,21S,22R,25S)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1^{2,5}.0^{3,18}.0^{3,21}.0^{6,15}.0^{9,14}]heptacosa-8,10-diene-13,19,24,27-tetrone
Physalin M belongs to the class of organic compounds known as physalins and derivatives. These are steroidal constituents of Physalis plants which possess an unusual 13,14-seco-16,24-cyclo-steroidal ring skeleton (where the bond that is normally present between the 13 and 14 positions in other steroids is broken while a new bond between positions 16 and 24 is formed). Physalin M is an extremely weak basic (essentially neutral) compound (based on its pKa). Physalin M is found in fruits. Physalin M is a constituent of Physalis alkekengi (winter cherry). Constituent of Physalis alkekengi (winter cherry). Physalin M is found in fruits.
alpha-alectoronic acid
3,9-dihydroxy-6-oxo-1,7-bis(2-oxoheptyl)benzo[b][1,4]benzodioxepine-2-carboxylic acid
1,2alpha-dehydro-3beta,4beta-dioxolan-daphnetoxin-21-one|genkwanin I
1,2alpha-dehydro-3beta,4beta-dioxolan-daphnetoxin-21-one|genkwanin I
11-oxo-7alpha-obacunyl acetate|11-Oxo-7??-obacunyl acetate
11-oxo-7alpha-obacunyl acetate|11-Oxo-7??-obacunyl acetate
Physalin M
5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1^{2,5}.0^{3,18}.0^{3,21}.0^{6,15}.0^{9,14}]heptacosa-8,10-diene-13,19,24,27-tetrone
ST 26:8;O7
(1beta,3beta,5beta)-1,3,5-[(1R)-ethylidynetris(oxy)]-2beta-acetoxy-14beta-15beta,16beta-epoxy-19-oxo-bufa-20,22-dienolide
(1r)-2-[(3r)-3-acetyl-2,2-dimethyl-6-oxopyran-3-yl]-1-[(1r,3s,6s,7s,11s)-6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
(1r)-2-[(3r)-3-acetyl-2,2-dimethyl-6-oxopyran-3-yl]-1-[(1r,3s,6s,7s,11s)-6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
6,14-dihydroxy-10-oxo-4,12-bis(2-oxoheptyl)-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid
6,14-dihydroxy-10-oxo-4,12-bis(2-oxoheptyl)-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaene-5-carboxylic acid
(1r,3s,4s,5z,7r,8r)-3-hydroxy-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethyl-7-[(1e)-prop-1-en-1-yl]-8-[(5r)-2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl]bicyclo[2.2.2]octane-2,6-dione
(1r,3s,4s,5z,7r,8r)-3-hydroxy-5-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-1,3-dimethyl-7-[(1e)-prop-1-en-1-yl]-8-[(5r)-2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl]bicyclo[2.2.2]octane-2,6-dione
12-(2,3-dihydroxy-3-methylbutyl)-5,8,9-trihydroxy-7-(4-hydroxy-3-methylbut-2-en-1-yl)-2,2-dimethyl-1,11-dioxatetracen-6-one
12-(2,3-dihydroxy-3-methylbutyl)-5,8,9-trihydroxy-7-(4-hydroxy-3-methylbut-2-en-1-yl)-2,2-dimethyl-1,11-dioxatetracen-6-one
7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
5,13,17-trihydroxy-7-(2-oxoheptyl)-17-pentyl-2,10,16-trioxatetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadeca-1(19),3(8),4,6,11,13-hexaene-9,15-dione
5,13,17-trihydroxy-7-(2-oxoheptyl)-17-pentyl-2,10,16-trioxatetracyclo[9.8.0.0³,⁸.0¹⁴,¹⁹]nonadeca-1(19),3(8),4,6,11,13-hexaene-9,15-dione
4,6-dihydroxy-3-[(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy]-2-(2-oxoheptyl)benzoic acid
4,6-dihydroxy-3-[(6-hydroxy-1-oxo-3-pentylisochromen-8-yl)oxy]-2-(2-oxoheptyl)benzoic acid
11-oxo-7α-obacunyl acetate
NA
{"Ingredient_id": "HBIN000499","Ingredient_name": "11-oxo-7\u03b1-obacunyl acetate","Alias": "NA","Ingredient_formula": "C28H32O9","Ingredient_Smile": "CC(=O)OC1CC2C(OC(=O)C=CC2(C3C1(C45C(O4)C(=O)OC(C5(CC3=O)C)C6=COC=C6)C)C)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16387","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6,7,12-trihydroxy-4,13-bis(1-hydroxyhexa-2,4-dien-1-ylidene)-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione
6,7,12-trihydroxy-4,13-bis(1-hydroxyhexa-2,4-dien-1-ylidene)-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione
2-(3-acetyl-2,2-dimethyl-6-oxopyran-3-yl)-1-[6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
2-(3-acetyl-2,2-dimethyl-6-oxopyran-3-yl)-1-[6-(furan-3-yl)-7,11-dimethyl-4-oxo-2,5-dioxatricyclo[5.4.0.0¹,³]undec-9-en-11-yl]ethyl acetate
4,13-bis(hexa-2,4-dienoyl)-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one
4,13-bis(hexa-2,4-dienoyl)-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one
3-{[3-carboxy-5-(hexa-1,3-dien-1-yl)-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid
3-{[3-carboxy-5-(hexa-1,3-dien-1-yl)-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid
15-(2,2-dimethyl-5-oxooxolan-3-yl)-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
15-(2,2-dimethyl-5-oxooxolan-3-yl)-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
(1s,2s,3r,5r,6r,14r,15s,18r,21s,22r,25s)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone
(1s,2s,3r,5r,6r,14r,15s,18r,21s,22r,25s)-5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone
12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one
12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2z)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one
(1r,3s,5r,7r,8r,9r,10r,15r)-15-[(3r)-2,2-dimethyl-5-oxooxolan-3-yl]-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
(1r,3s,5r,7r,8r,9r,10r,15r)-15-[(3r)-2,2-dimethyl-5-oxooxolan-3-yl]-8,15-dimethyl-2-methylidene-12-oxo-7-(2-oxo-5h-furan-3-yl)-4,11-dioxatetracyclo[8.5.0.0³,⁵.0³,⁸]pentadec-13-en-9-yl acetate
(1r,2r,4s,7s,8s,10s,12r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate
(1r,2r,4s,7s,8s,10s,12r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate
(1r,2s,4s,5s,9s,10s,11r,13s,14s,15r,17r,19r,21r)-10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
(1r,2s,4s,5s,9s,10s,11r,13s,14s,15r,17r,19r,21r)-10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
10-hydroxy-11-(hydroxymethyl)-4,21-dimethyl-17-phenyl-19-(prop-1-en-2-yl)-6,8,12,16,18,22-hexaoxaheptacyclo[15.4.1.0¹,¹⁴.0²,⁹.0⁵,⁹.0¹¹,¹³.0¹⁵,¹⁹]docosan-7-one
(1r,2r,4e,6s,7s,9s,13z)-6,7,10-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
(1r,2r,4e,6s,7s,9s,13z)-6,7,10-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
(1r,2r,4z,6s,7s,9s,13z)-6,7,12-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione
(1r,2r,4z,6s,7s,9s,13z)-6,7,12-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-11-ene-3,5,10-trione
(3s,5s,7r,8s)-3-{[(5r)-3-carboxy-5-[(1e,3e)-hexa-1,3-dien-1-yl]-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid
(3s,5s,7r,8s)-3-{[(5r)-3-carboxy-5-[(1e,3e)-hexa-1,3-dien-1-yl]-5-methyl-4-oxofuran-2-yl]methyl}-11-hydroxy-7,8,10-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),9,11-triene-12-carboxylic acid
12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one
12-[(2s)-2,3-dihydroxy-3-methylbutyl]-5,8,9-trihydroxy-7-[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]-2,2-dimethyl-1,11-dioxatetracen-6-one
7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate
7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-10-yl acetate
(1r,2r,4z,6s,7s,9s,13z)-6,7,10-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
(1r,2r,4z,6s,7s,9s,13z)-6,7,10-trihydroxy-4,13-bis[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
3-hydroxy-5-(1-hydroxyhexa-2,4-dien-1-ylidene)-1,3-dimethyl-7-(prop-1-en-1-yl)-8-(2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl)bicyclo[2.2.2]octane-2,6-dione
3-hydroxy-5-(1-hydroxyhexa-2,4-dien-1-ylidene)-1,3-dimethyl-7-(prop-1-en-1-yl)-8-(2,4,5-trihydroxy-3,5-dimethyl-6-oxocyclohexa-1,3-diene-1-carbonyl)bicyclo[2.2.2]octane-2,6-dione
(1s,2r,4s,7s,8s,11r,12s,18r,20r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,10,15-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-20-yl acetate
(1s,2r,4s,7s,8s,11r,12s,18r,20r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,10,15-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-20-yl acetate
(5ar,7ar,11as,11bs)-7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
(5ar,7ar,11as,11bs)-7a,11b-dihydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
(1r,2r,6s,7r,9s)-4,13-bis[(2e,4e)-hexa-2,4-dienoyl]-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one
(1r,2r,6s,7r,9s)-4,13-bis[(2e,4e)-hexa-2,4-dienoyl]-3,6,7,10,12-pentahydroxy-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]trideca-3,10,12-trien-5-one
(5ar,7ar,11as,11bs)-7a,11b-dihydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
(5ar,7ar,11as,11bs)-7a,11b-dihydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8,11a-tetramethyl-7,12-dihydro-6h-2,5-dioxatetraphene-1,11-dione
6,7,10-trihydroxy-4-(1-hydroxyhexa-2,4-dien-1-ylidene)-13-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
6,7,10-trihydroxy-4-(1-hydroxyhexa-2,4-dien-1-ylidene)-13-[(2e,4e)-1-hydroxyhexa-2,4-dien-1-ylidene]-2,6,9,11-tetramethyl-8-oxatricyclo[7.4.0.0²,⁷]tridec-10-ene-3,5,12-trione
5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone
5,18-dihydroxy-1,14,21,25-tetramethyl-4,20,23-trioxaheptacyclo[20.3.1.1²,⁵.0³,¹⁸.0³,²¹.0⁶,¹⁵.0⁹,¹⁴]heptacosa-8,10-diene-13,19,24,27-tetrone
7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,10,15-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-20-yl acetate
7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,10,15-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icos-13-en-20-yl acetate
Territrem C
(1S,2S,7R,10R)-1,7-dihydroxy-14-(4-hydroxy-3,5-dimethoxyphenyl)-2,6,6,10-tetramethyl-11,15-dioxatetracyclo[8.8.0.02,7.012,17]octadeca-4,12(17),13-triene-3,16-dione
Territrem C has been reported in Penicillium with data available. Territrem C is a tremorgenic mycotoxin found in the fungus Aspergillus terreus, which has been know to contaminate rice crops. Tremorgenic mycotoxins affect central nervous system activity, with their defining characteristic being the tremors that they cause. Territrems induce this effect by inhibiting the enzyme acetylcholinesterase in peripheral nerve endings. (A3028, A3029)
