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11-Deoxycortisol-[2,2,4,6,6-d5]

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General Information
Catalog: BLP-012924
CAS: 1258063-56-7
Molecular Formula: C21H25D5O4
Molecular Weight: 351.49

Chemical Structure

Description	11-Deoxycortisol-[2,2,4,6,6-d5] is the labelled analogue of 11-Deoxycortisol, which is a glucocorticoid receptor antagonist. It is an intermediate which can be oxygenated to cortisol.
Synonyms	11-Deoxy-17-hydroxycorticosterone-2,2,4,6,6-d5; 17,21-Dihydroxyprogesterone-2,2,4,6,6-d5; Cortexolone-2,2,4,6,6-d5; 11-Deoxycortisol-2,2,4,6,6-d5; 11-Deoxycortisol-D5
IUPAC Name	(8R,9S,10R,13S,14S,17R)-2,2,4,6,6-pentadeuterio-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Related CAS	152-58-9 (unlabelled)
Canonical SMILES	CC12CCC(=O)C=C1CCC3C2CCC4(C3CCC4(C(=O)CO)O)C
InChI	InChI=1S/C21H30O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h11,15-17,22,25H,3-10,12H2,1-2H3/t15-,16+,17+,19+,20+,21+/m1/s1/i3D2,5D2,11D
InChI Key	WHBHBVVOGNECLV-NGKMQDFHSA-N
Melting Point	208°C (dec.)
Purity	95% by HPLC; 98% atom D
Solubility	Soluble in Dioxane (Slightly, Heated, Sonicated), DMSO (Slightly), Methanol (Slightly, Heat)
Appearance	White Solid
Storage	Store at -20°C