Pregna-4,17(20)-dien-21-oic acid, 3,11-dioxo-, methyl ester
methyl 2-[(8S,9S,10R,13S,14S)-10,13-dimethyl-3,11-dioxo-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-ylidene]acetate
Also Known As: Methyl 3,11-dioxopregna-4,17-dien-21-oate|Pregna-4,17(20)-dien-21-oic acid, 3,11-dioxo-, methyl ester
CAS: 37002-70-3
| Molecular Formula | C22H28O4 |
|---|---|
| Molecular Weight | 356.19876 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.19876 |
| Monoisotopic Mass | 356.19876 |
| Heavy Atoms | 26 |
| Complexity | 745.0 |
Chemical Identifiers
| CAS Number | 37002-70-3 |
|---|---|
| SMILES | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CCC4=CC(=O)OC)C |
| InChIKey | MVLYYRYIEZOWIZ-RGBOINFLSA-N |
Product Overview
Pregna-4,17(20)-dien-21-oic acid, 3,11-dioxo-, methyl ester (CAS 37002-70-3), with molecular formula C22H28O4 and molecular weight 356.19876 g/mol. IUPAC: methyl 2-[(8S,9S,10R,13S,14S)-10,13-dimethyl-3,11-dioxo-1,2,6,7,8,9,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-ylidene]acetate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Pregna-4,17(20)-dien-21-oic acid, 3,11-dioxo-, methyl ester is a custom synthesis product. We offer services from milligram to kilogram scale.
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