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6-β-Hydroxy Cortisol-[d4]

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General Information
Catalog: BLP-003113
CAS: 1261254-51-6
Molecular Formula: C21H26D4O6
Molecular Weight: 382.48

Chemical Structure

Description	Labelled 6β-Hydroxy Cortisol. A labelled metabolite of Cortisol.
Synonyms	(6β,11β)-6,11,17,21-Tetrahydroxypregn-4-ene-3,20-dione-d4; 6β,17-Dihydroxycorticosterone-d4; 6β,11β,17α,21-Tetrahydroxypregn-4-en-3,20-dione-d4; NSC 76163-d4; (8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydro11,12,13,14,15,16,17-dpenta[a]phenanthren-3(2H)-one D4
IUPAC Name	(6R,8S,9S,10R,11S,13S,14S,17R)-9,11,12,12-tetradeuterio-6,11,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Related CAS	53-35-0 (unlabelled)
Canonical SMILES	CC12CCC(=O)C=C1C(CC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O)O
InChI	InChI=1S/C21H30O6/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,22,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15+,16-,18+,19-,20-,21-/m0/s1/i9D2,16D,18D
InChI Key	GNFTWPCIRXSCQF-CNXOBPSJSA-N
Melting Point	193-201°C
Purity	> 98%
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White to Light Beige Solid
Storage	-20°C