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4-Pregnen-21-OL-3,20-dione-[2,2,4,6,6,17alpha,21,21-d8]

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General Information
Catalog: BLP-008884
CAS: 55487-63-3
Molecular Formula: C21H22D8O3
Molecular Weight: 338.52

Chemical Structure

Description	4-Pregnen-21-OL-3,20-dione-[2,2,4,6,6,17alpha,21,21-d8] is a labelled analogue of 21-Hydroxyprogesterone, a mineralocorticoid.
Synonyms	21-hydroxyprogesterone-d8; 21-Hydroxypregn-4-ene-3,20-dione-d8; 11-Deoxycorticosterone-d8; 11-Dehydroxy-corticosterone-d8; 11-Desoxycorticosterone-d8; 21-Hydroxy-3,20-dioxopregn-4-ene-d8; 21-Hydroxy-4-pregnane-3,20-dione-d8; Cortexone-d8; DOC-d8; Deoxycortone-d8; Desoxycorticosterone-d8; Desoxycortone-d8; NSC 11319-d8; 4-Pregnene-21-ol-3,20-dione-d8
IUPAC Name	(8S,9S,10R,13S,14S,17S)-2,2,4,6,6,17-hexadeuterio-17-(2,2-dideuterio-2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthren-3-one
Related CAS	64-85-7 (unlabelled)
Canonical SMILES	CC12CCC3C(C1CCC2C(=O)CO)CCC4=CC(=O)CCC34C
InChI	InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1/i3D2,7D2,11D,12D2,18D
InChI Key	ZESRJSPZRDMNHY-JRMIWGODSA-N
Melting Point	132-134°C
Purity	≥97%; ≥98% atom D
Solubility	Soluble in Chloroform (Slightly), Methanol (Slightly)
Appearance	White to Pale Beige Solid
Application	Labelled Deoxycorticosterone. Occurs in adrenal cortex. Mineralocorticoid.
Storage	Store at -20°C