Chemical Formula: C28H38O7
Chemical Formula C28H38O7
Found 248 metabolite its formula value is C28H38O7
(4beta,5beta,6beta,14beta,15alpha,20S,22R)-5,6-Epoxy-4,14,15-trihydroxy-1-oxowitha-2,24-dienolide
(4beta,5beta,6beta,14beta,15alpha,20S,22R)-5,6-Epoxy-4,14,15-trihydroxy-1-oxowitha-2,24-dienolide is found in fruits. (4beta,5beta,6beta,14beta,15alpha,20S,22R)-5,6-Epoxy-4,14,15-trihydroxy-1-oxowitha-2,24-dienolide is a constituent of Physalis peruviana (Cape gooseberry). Constituent of Physalis peruviana (Cape gooseberry). (4beta,5beta,6beta,14beta,15alpha,20S,22R)-5,6-Epoxy-4,14,15-trihydroxy-1-oxowitha-2,24-dienolide is found in fruits.
Eucalyptone
Eucalyptone is a constituent of Eucalyptus globulus (Tasmanian bluegum). Constituent of Eucalyptus globulus (Tasmanian bluegum)
Withaperuvin C
Withaperuvin C is found in fruits. Withaperuvin C is a constituent of Physalis peruviana (Cape gooseberry). Constituent of Physalis peruviana (Cape gooseberry). Withaperuvin C is found in fruits.
24,25-Epoxywithanolide D
24,25-Epoxywithanolide D is found in fruits. 24,25-Epoxywithanolide D is a constituent of the famine food Physalis angulata (cutleaf ground cherry).
Prednisolone valerate acetate
Physapruin A
Constituent of Physalis pruinosa (strawberry tomato). Physapruin A is found in fruits.
Andrastin A
A 19-oxo steroid that is that is andrastin B in which the hydroxy group at position 19 has been oxidised to give the corresponding aldehyde. A farnesyltransferase inhibitor produced by Penicillium roqueforti, a filamentous fungus involved in the ripening of several kinds of blue cheeses.
(5alpha,6alpha,7alpha,12beta,15beta,22R)-6,7-epoxy-5,12,15,22-tetrahydroxy-1-oxoergosta-2,24-dien-26-oic acid delta-lactone|baimantuoluoline A
eucalyptal B
An organic heterotetracyclic compound whose skeleton is composed of 3,5-diformyl-isopentyl substituted phloroglucinol fused with a cadinane ring system. Isolated from Eucalyptus globulus, it exhibits antineoplastic activity.
(20R,22R)-5beta,6beta-epoxy-4beta,12beta,20-trihydroxy-1-oxowith-2-en-24-enolide
3-O-beta-D-Xylopyranoside-3-Hydroxycarda-14,16,20(22)-trienolide
9-[1-(4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)-1-hydroxyethyl]-6,9-dihydroxy-9a,11b-dimethyl-5a,6,6a,6b,7,8,9,9a,10,11,11a,11b-dodecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-1(4H)-one #
27-hydroxy-withanolide A|27-hydroxywithanolide A|5alpha,20alphaF(R),27-trihydroxy-6alpha,7alpha-epoxy-1-oxowitha-2,24-dienolide|withasomniferol A
(15S,17S)-14,15,17,20-tetrahydroxy-22,26-epoxyergosta-2,5,24-triene-1,26-dione|(22R)-14alpha,15alpha,17beta,20beta-tetrahydroxy-1-oxowitha-2,5,24-trien-26,22-olide
(17S,20R,22R)-5beta,6beta-epoxy-4beta,18,20-trihydroxy-1-oxowitha-2,24-dienolide|18-hydroxy-withanolide D|18-hydroxywithanolide D
(20S,22R)-14alpha,17beta,20beta,27-tetrahydroxy-1-oxowitha-2,5,24-trienolide|withacoagulin D
20-(carboxymethyl)-6-methoxy-2,5,17-trimethyldocosa-2,4,8,10,14,18,20-heptaenedioic acid
6alpha,7alpha-epoxy-1-oxo-5alpha,12alpha,17alpha-trihydroxywitha-2,24-dienolide
(22R)-4alpha,17alpha,27-trihydroxy-1-oxo-witha-2,5,24-trienolide
(20R,22R)-5beta,6beta:12alpha,21-diepoxy-12beta,17beta-dihydroxy-1-oxowitha-24-en-26,22-olide|jaborosalactone 39
(1S,3R,4aR,6aS,12aR,12bS)-1,2,3,4a,5,6,6a,12,12a,12b-decahydro-1-hydroxy-3-(2-hydroxypropan-2-yl)-6a,12b-dimethyl-9-[(S,E)-4-methyl-3-oxohex-4-en-2-yl]pyrano[3,2-a]xanthene-8,11-dione|19alpha-hydroxy-2,3-didehydro-14-epicochlioquinone B
(14R,15R,17S,20S,22R)-14,15,17,20-tetrahydroxy-1-oxowitha-3,5,24-trienolide|withacoagulide B
(20R,22R)-4beta,14alpha,20,27-tetrahydroxy-1-oxoergosta-2,5,24-trieno-26,22-lactone|(20R,22R)-4beta,14alpha,20,27-tetrahydroxy-1-oxowitha-2,5,24-trienolide|ajugin C
(17S,20R,22R)-5beta,6beta:18,20-diepoxy-4beta,18-dihydroxy-1-oxowitha-24-enolide
(15S,17R,20R,22R,24S,25S,26R)-5beta,6beta:22,26:24,25-triepoxy-14alpha,17,26-trihydroxy-15,21-cycloergost-2-en-1-one|jaborosalactol 18
C28H38O7_Methyl (3beta,5beta,8alpha,9beta,10alpha,13alpha)-3-acetoxy-4,4,8,12,16-pentamethyl-15,17,19-trioxoandrost-11-ene-14-carboxylate
Bongkrekic acid
A tricarboxylic acid that is docosa-2,4,8,10,14,18,20-heptaenedioic acid substituted at positions 2 ,5 and 17 by methyl groups, at positions 6 by a methoxy group and at position 20 by a carboxymethyl group. It is produced by the bacterium Burkholderia gladioli and implicated in outbreaks of food-borne illness involving coconut and corn-based products in Indonesia and China. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents
(4beta,5beta,6beta,14beta,15alpha,20S,22R)-5,6-Epoxy-4,14,15-trihydroxy-1-oxowitha-2,24-dienolide
Withaperuvin C
24,25-Epoxywithanolide D
eucalyptone
Withalongolide A
A withanolide that is withaferin A substituted by a hydroxy group at position 19. Isolated from Physalis longifolia, it exhibits antineoplastic activitiy.
Prednisolone valerate acetate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
Withalongolide C
A withanolide that is withaferin A substituted by a hydroxy group at position 11. Isolated from Physalis longifolia, it exhibits antineoplastic activity.
methyl 3-acetyloxy-10-formyl-4,4,8,12,13,16-hexamethyl-15,17-dioxo-2,3,5,6,7,9-hexahydro-1H-cyclopenta[a]phenanthrene-14-carboxylate
2-[1-Hydroxy-1-(4,14,17-trihydroxy-10,13-dimethyl-1-oxo-4,7,8,9,11,12,15,16-octahydrocyclopenta[a]phenanthren-17-yl)ethyl]-4,5-dimethyl-2,3-dihydropyran-6-one
17alpha-hydroxywithanolide D
A withanolide that is the 17alpha-hydroxy derivative of withanolide D. Isolated from Tubocapsicum anomalum and Withania somnifera, it exhibits cytotoxic activity.
acetic acid [(1R,4bR,5R,8R,10S,10aS,12aS)-1-(3-furanyl)-8,10-dihydroxy-4b,7,7,10a,12a-pentamethyl-3-oxo-1,5,6,6a,8,9,10,10b,11,12-decahydronaphtho[2,1-f][2]benzopyran-5-yl] ester
Methyl 3beta-acetoxy-15-hydroxy-4,4,8alpha,12,16-pentamethyl-17,19-dioxo-5beta,9beta,10alpha,13alpha-androsta-11,15-diene-14-carboxylate
(2E,4E,8E,10E,14E,18E,20E)-20-(carboxymethyl)-6-methoxy-2,5,17-trimethyldocosa-2,4,8,10,14,18,20-heptaenedioic acid
(6r)-6-[(1r)-1-[(1s,3as,3bs,4s,9ar,9bs,11ar)-4-hydroxy-11a-(hydroxymethyl)-9a-methyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one
7-hydroxy-16-{1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-2,17-dimethyl-5,9-dioxahexacyclo[10.7.0.0²,⁸.0⁴,⁶.0⁸,¹⁰.0¹³,¹⁷]nonadecan-3-one
(1s,2r,6s,7r,9r,11s,12s,15s,16s)-15-[(1r)-1-[(1s,4r,6s)-1,6-dimethyl-2-oxo-3,7-dioxabicyclo[4.1.0]heptan-4-yl]-1-hydroxyethyl]-6-hydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
(2r,4s,4as,4br,10as,12ar)-4-hydroxy-2-(2-hydroxypropan-2-yl)-4a,10a-dimethyl-8-[(2s,4e)-4-methyl-3-oxohex-4-en-2-yl]-2,3,4,4b,5,11,12,12a-octahydro-1,10-dioxatetraphene-6,9-dione
(1r,5r,8r)-8-[(5r,5ar,11r)-5,5a,11-trihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-5-methyl-4-methylidene-2,6-dioxabicyclo[3.3.1]nonan-3-one
(1s,2s,4s,5r,10r,11s,13r,14r,15r,18s)-5,13-dihydroxy-15-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one
3-(hydroxymethyl)-4-methyl-6-(1-{1,2,6-trihydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3ah,3bh,4h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}ethyl)-5,6-dihydropyran-2-one
(1r,4r,5r,7s)-7-[(1r,3as,3bs,5ar,8r,9ar,9bs,11as)-1,5a,8-trihydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3ah,3bh,8h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-4-hydroxy-4,5-dimethyl-2-oxabicyclo[3.2.1]octan-3-one
(1s,2s,4r,6s,11r,12s,14s,17r,18r,21s)-17-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-14,18-dihydroxy-11,21-dimethyl-5,15-dioxahexacyclo[12.6.1.0²,¹².0⁴,⁶.0⁶,¹¹.0¹⁸,²¹]henicosan-10-one
(1s,2r,4s,5r,6r,7s,9r,12r)-5-(acetyloxy)-4-hydroxy-2,6,10,10-tetramethyl-7-{[(2e)-3-phenylprop-2-en-1-yl]oxy}-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-12-yl acetate
(1s,2r,4s,7s,8s,11r,12s,15s,17r,19r)-7-(furan-3-yl)-15-hydroxy-1,8,12,16,16-pentamethyl-5-oxo-3,6-dioxapentacyclo[9.8.0.0²,⁴.0²,⁸.0¹²,¹⁷]nonadecan-19-yl acetate
1,3,9a-trihydroxy-6-(2-hydroxypropan-2-yl)-11a-methyl-9-methylidene-12-(2-methylpropyl)-5a,5b,6,7,8,10,11,12-octahydro-5-oxatetraphene-2,4-dicarbaldehyde
(1r,2r,6s,7r,9r,11r,12s,15r,16s)-15-[(1s)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]-1-hydroxyethyl]-6,15-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
15-[1-(4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5,15,18-trihydroxy-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one
(1s,2r,7s,9r,11r,12s,15r,16s)-15-[(1r)-1-[(1s,4r,6s)-1,6-dimethyl-2-oxo-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-12,15-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
6-hydroxy-15-{1-hydroxy-1-[5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl}-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
(6r)-6-[(1r)-1-[(1s,2s,3as,3bs,6r,9ar,9bs,11as)-1,2,6-trihydroxy-9a,11a-dimethyl-9-oxo-2h,3h,3ah,3bh,4h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one
(1s,2r,6s,7r,9r,11s,12s,15s,16s)-6-hydroxy-15-[(1r)-1-hydroxy-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one
(6r)-6-[(1r)-1-[(1s,3ar,3br,6s,9ar,9bs,11ar)-3a,6-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3bh,4h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one
18-hydroxywithanolide d
{"Ingredient_id": "HBIN002137","Ingredient_name": "18-hydroxywithanolide d","Alias": "NA","Ingredient_formula": "C28H38O7","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)(C2CCC3C2(CCC4C3CC5C6(C4(C(=O)C=CC6O)C)O5)CO)O)C","Ingredient_weight": "486.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10826","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21606687","DrugBank_id": "NA"}
(20s,22r)-5β,6β-epoxy-4β,14β,15α-trihydroxy-1-oxowith-2,24-dienolide
{"Ingredient_id": "HBIN003478","Ingredient_name": "(20s,22r)-5\u03b2,6\u03b2-epoxy-4\u03b2,14\u03b2,15\u03b1-trihydroxy-1-oxowith-2,24-dienolide","Alias": "NA","Ingredient_formula": "C28H38O7","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2CC(C3(C2(CCC4C3CC5C6(C4(C(=O)C=CC6O)C)O5)C)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7213","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5β,6β-epoxy-4β,17α,27-trihydroxy-1-oxowitha-2,24-dienolide
{"Ingredient_id": "HBIN011453","Ingredient_name": "5\u03b2,6\u03b2-epoxy-4\u03b2,17\u03b1,27-trihydroxy-1-oxowitha-2,24-dienolide","Alias": "NA","Ingredient_formula": "C28H38O7","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2(CCC3C2(CCC4C3CC5C6(C4(C(=O)C=CC6O)C)O5)C)O)CO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7209","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugin e
{"Ingredient_id": "HBIN014988","Ingredient_name": "ajugin e","Alias": "NA","Ingredient_formula": "C28H38O7","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)(C2(CCC3(C2(CCC4C3CC=C5C4(C(=O)CC=C5)C)C)O)O)O)CO","Ingredient_weight": "486.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "813","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101010478","DrugBank_id": "NA"}