Product Code
TRC-K170980
Product Format
Neat
Molecular Formula
C26H31NO3
Molecular Weight
405.53
Product Categories
TRC, Cancer Research Chemicals and Analytical Standards, Impurity Reference Materials
Purity
>95% (HPLC)
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DismissAnalyte Name
7-Ketoabiraterone Acetate
Molecular Formula
C26H31NO3
Molecular Weight
405.53
Accurate Mass
405.2304
SMILES
CC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC=C4c5cccnc5)[C@@H]3C(=O)C=C2C1
InChI
InChI=1S/C26H31NO3/c1-16(28)30-19-8-10-25(2)18(13-19)14-23(29)24-21-7-6-20(17-5-4-12-27-15-17)26(21,3)11-9-22(24)25/h4-6,12,14-15,19,21-22,24H,7-11,13H2,1-3H3/t19-,21-,22-,24-,25-,26+/m0/s1
IUPAC
[(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-7-oxo-17-(3-pyridyl)-1,2,3,4,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-3-yl] acetate
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
Purity
>95% (HPLC)
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