For research use only. Not for therapeutic Use.
11-Keto budesonide (Cat No.:R058655) is a chemical compound representing a mixture of diastereomers. It is a derivative of budesonide, a corticosteroid used in the treatment of inflammatory conditions like asthma and Crohn’s disease. The presence of the 11-keto group introduces specific reactivity and potential changes in biological activity. The mixture of diastereomers reflects the possible stereoisomers at the 11-keto position. Studying these mixtures helps elucidate structure-activity relationships and their influence on drug efficacy.
Catalog Number | R058655 |
CAS Number | 216453-74-6 |
Synonyms | (16α)-16,17-[Butylidenebis(oxy)]-21-hydroxypregna-1,4-diene-3,11,20-trione; Budesonide Impurity L (EP) |
Molecular Formula | C25H32O6 |
Purity | ≥95% |
Storage | -20°C |
IUPAC Name | (1S,2S,4R,8S,9S,12S,13R)-8-(2-hydroxyacetyl)-9,13-dimethyl-6-propyl-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-diene-11,16-dione |
InChI | InChI=1S/C25H32O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-17,20-22,26H,4-7,11-13H2,1-3H3/t16-,17-,20+,21?,22+,23-,24-,25+/m0/s1 |
InChIKey | NTERSHSWHLAIHV-ADKFLVHOSA-N |
SMILES | CCCC1OC2CC3C4CCC5=CC(=O)C=CC5(C4C(=O)CC3(C2(O1)C(=O)CO)C)C |