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Cyproterone Acetate-[d3]

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General Information
Catalog: BLP-003509
Molecular Formula: C24H26D3ClO4
Molecular Weight: 419.97

Chemical Structure

Description	Cyproterone Acetate-d3, is the labelled analogue of Cyproterone Acetate, which combined with estrogen it is used in the treatment of acne.
Synonyms	(1β,2β)-17-(Acetyloxy)-6-chloro-1,2-dihydro-3'H-cyclopropa[1,2]pregna-1,4,6-triene-3,20-dione-d3; 1,2α-Methylene-6-chloro-pregna-4,6-diene-3,20-dione 17α-Acetate-d3; Cyproterone Acetate D3
IUPAC Name	[(1S,2S,3S,5R,11R,12S,15R,16S)-15-acetyl-9-chloro-2,16-dimethyl-6-oxo-15-pentacyclo[9.7.0.02,8.03,5.012,16]octadeca-7,9-dienyl] 2,2,2-trideuterioacetate
Related CAS	427-51-0 (unlabelled)
Canonical SMILES	CC(=O)C1(CCC2C1(CCC3C2C=C(C4=CC(=O)C5CC5C34C)Cl)C)OC(=O)C
InChI	InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14-,15+,16-,17-,18-,22-,23-,24-/m0/s1/i2D3
InChI Key	UWFYSQMTEOIJJG-JQTROKFWSA-N
Melting Point	197-203°C
Purity	> 98%
Solubility	Soluble in Acetone, Chloroform, Methanol
Appearance	White to Pale Yellow Solid
Storage	Store at -20°C