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Product Overview

Product Code

TRC-A108540

CAS Number

2378463-76-2

Product Format

Neat

Molecular Formula

C24 H31 N O2

Molecular Weight

365.5084

API Family

Abiraterone Acetate

Product Categories

TRC, Impurity Reference Materials

Product Type

Native/Parent, Impurity

Documentation

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Product Information

Chemical Data

Analyte Name

Abiraterone N-Oxide

CAS Number

2378463-76-2

Molecular Formula

C24 H31 N O2

Molecular Weight

365.5084

Accurate Mass

365.2355

SMILES

C[C@]12CC[C@H]3[C@@H](CC=C4C[C@@H](O)CC[C@]34C)[C@@H]1CC=C2c5ccc[n+]([O-])c5

InChI

InChI=1S/C24H31NO2/c1-23-11-9-18(26)14-17(23)5-6-19-21-8-7-20(16-4-3-13-25(27)15-16)24(21,2)12-10-22(19)23/h3-5,7,13,15,18-19,21-22,26H,6,8-12,14H2,1-2H3/t18-,19-,21-,22-,23-,24+/m0/s1

IUPAC

(3S,8R,9S,10R,13S,14S)-10,13-dimethyl-17-(1-oxidopyridin-1-ium-3-yl)-2,3,4,7,8,9,11,12,14,15-decahydro-1H-cyclopenta[a]phenanthren-3-ol

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Abiraterone Acetate

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