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Flunisolide Acetate-[d6]

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General Information
Catalog: BLP-006583
Molecular Formula: C26H27D6FO7
Molecular Weight: 482.57

Chemical Structure

Description	Flunisolide Acetate-[d6], is the labelled analogue of Flunisolide Acetate, which is an intermediate of Flunisolide. Flunisolide is a corticosteroid often prescribed as treatment for allergic rhinitis.
Synonyms	Flunisolide Acetate-D6; 6α,11β,16α)-21-(Acetyloxy)-6-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]-pregna-1,4-diene-3,20-dione-d6; 21-Acetate 6α-Fluoro-11β,16α,17,21-tetrahydroxy-pregna-1,4-diene-3,20-dione Cyclic 16,17-Acetal with Acetone-d6; (6α,11β,16α)-21-(Acetyloxy)-6-fluoro-11-hydroxy-16,17-[(1-methylethylidene)bis(oxy)]pregna-1,4-diene-3,20-dione-d6; 6α-Fluoro-16α,17α-isopropylidenedioxypregna-1,4-diene-11β,21-diol-3,20-dione 21-Acetate-d6
IUPAC Name	[2-[(4R,8S,9S,11S,13R,19S)-19-fluoro-11-hydroxy-9,13-dimethyl-16-oxo-6,6-bis(trideuteriomethyl)-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icosa-14,17-dien-8-yl]-2-oxoethyl] acetate
Related CAS	4533-89-5 (unlabelled)
Canonical SMILES	CC(=O)OCC(=O)C12C(CC3C1(CC(C4C3CC(C5=CC(=O)C=CC45C)F)O)C)OC(O2)(C)C
InChI	InChI=1S/C26H33FO7/c1-13(28)32-12-20(31)26-21(33-23(2,3)34-26)10-16-15-9-18(27)17-8-14(29)6-7-24(17,4)22(15)19(30)11-25(16,26)5/h6-8,15-16,18-19,21-22,30H,9-12H2,1-5H3/t15?,16?,18-,19-,21+,22?,24-,25-,26+/m0/s1/i2D3,3D3
InChI Key	WEGNFRKBIKYVLC-UVOKQUFZSA-N
Boiling Point	593.9±50.0°C at 760 mmHg
Purity	97% by CP; 99% atom D
Density	1.3±0.1 g/cm3
Solubility	Soluble in Chloroform, Dichloromethane, Ethyl Acetate
Appearance	White Solid