N-Demethyl Mifepristone
Product Code
TRC-D230950
CAS Number
Product Format
Neat
Molecular Formula
C28 H33 N O2
Molecular Weight
415.57
API Family
MifepristoneProduct Categories
TRC, Hormones, Hormones, Steroids and derivatives, Impurity Reference Materials , Hormones, Steroids and derivatives
Product Type
MetabolitePurity
>95% (HPLC)
Drug Type
Steroids / Hormones
Documentation
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Product Information
Chemical Data
Analyte Name
N-Demethyl Mifepristone
CAS Number
104004-96-8
Molecular Formula
C28 H33 N O2
Molecular Weight
415.57
Accurate Mass
415.2511
SMILES
CNc1ccc(cc1)[C@H]2C[C@@]3(C)[C@@H](CC[C@@]3(O)C#CC)[C@@H]4CCC5=CC(=O)CCC5=C24
InChI
InChI=1S/C28H33NO2/c1-4-14-28(31)15-13-25-23-11-7-19-16-21(30)10-12-22(19)26(23)24(17-27(25,28)2)18-5-8-20(29-3)9-6-18/h5-6,8-9,16,23-25,29,31H,7,10-13,15,17H2,1-3H3/t23-,24+,25-,27-,28-/m0/s1
IUPAC
(8S,11R,13S,14S,17S)-17-hydroxy-13-methyl-11-[4-(methylamino)phenyl]-17-prop-1-ynyl-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-3-one
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Metabolite
Product Format
Neat
API Family
Purity
>95% (HPLC)
Product Description
A metabolite of Mifepristone (M343975).
References: Ringler, I., et al.: Metabolism, 13, 37 (1964),