| Primary information |
|---|
| ID | 20478 |
| Pubchem ID | 643658 |
| Name | Guggulsterone |
| Description | Guggulsterone is an ingredient in many nutritional supplements. |
| Synonym | (8XI;9xi;14xi;17E)-20-methoxypregna-4;17-diene-3;16-dione;20-Methoxy-4;17(20)e-pregnadiene-3;16-dione;4;17(20)-Pregnadiene-3;16-dione;Guggulsterone-m;(8XI;9xi;14xi;17E)-20-methoxypregna-4;17-diene-3;1 |
| Molecular Weight | 342.4718 |
| Formula | C22H30O3 |
| IUPAC | (1R;2R;10S;11S;14E;15S)-14-(1-methoxyethylidene)-2;15-dimethyltetracyclo[8.7.0.0²;⁷.0¹¹;¹⁵]heptadec-6-ene-5;13-dione |
| SMILE | [H][C@@]12CC(=O)C(=C(/C)OC)[C@@]1(C)CC[C@]1([H])[C@]2([H])CCC2=CC(=O)CC[C@]12C |
| PDB ID | NA |
| KEGG | NA |
| HMDB ID | HMDB0002726 |
| Melting Point (Degree C) | NA |
| Water Solubility | 13.75 mg/L at 25 °C |
| Drugbank ID | NA |
| Receptor | NA |
| Reference | HMDB
|