Prasteronyl Abiraterone

CAS: 2484719-09-5

Ref. TR-P701145

Product Information

• Name: Prasteronyl Abiraterone
• Synonyms: (3S,8R,9S,10R,13S,14S)-3-(((3S,8R,9S,10R,13S,14S)-10,13-Dimethyl-17-(pyridin-3-yl)-2,3,4,7,8,9,10,11,12,13,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl)oxy)-10,13-dimethyl-3,4,7,8,9,10,11,12,13,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17(2H)-one, Abiraterone Dimer Impurity, (3ß)-3-[[(3ß)-17-(3-Pyridinyl)androsta-5,16-dien-3-yl]oxy]androst-5-en-17-one
• CAS: 2484719-09-5

Description

Applications Prasteronyl Abiraterone is a dimer impurity of Abiraterone (A108490), a steroidal cytochrome P 450 17α-hydroxylase-17,20-lyase inhibitor (CYP17), is currently undergoing phase II clinical trials as a potential drug for the treatment of androgen-dependent prostate cancer.
References Denis, L., et al.: Cancer, 72, 3888 (1993); Potter, G.A., et al.: J. Med. Chem., 38, 2463 (1995); Denmeade, S., et al.: Nat. Rev., 2, 389(2002); Scher, H., et al.: J. Clin. Oncol., 23, 8253 (2005)

• Brand: TRC

Chemical properties

• Molecular weight: 619.92
• Formula: C₄₃H₅₇NO₂
• Color/Form: Neat
• InChI: InChI=1S/C43H57NO2/c1-40-19-15-30(24-28(40)7-9-32-35-12-11-34(27-6-5-23-44-26-27)42(35,3)21-17-37(32)40)46-31-16-20-41(2)29(25-31)8-10-33-36-13-14-39(45)43(36,4)22-18-38(33)41/h5-8,11,23,26,30-33,35-38H,9-10,12-22,24-25H2,1-4H3/t30-,31-,32-,33-,35-,36-,37-,38-,40-,41-,42+,43-/m0/s1
• InChI key: InChIKey=XAOLFYPGOVUKEI-GWYLZVEVSA-N
• SMILES: C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O[C@H]5CC[C@@]6(C)C(=CC[C@H]7[C@@H]8CC=C(c9cccnc9)[C@@]8(C)CC[C@@H]76)C5)CC[C@@]43C)[C@@H]1CCC2=O