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Product Overview

Product Code

TRC-D296005

CAS Number

159681-66-0

Product Format

Neat

Molecular Formula

C29 H35 N O4

Molecular Weight

461.59

API Family

Ulipristal, Ulipristal Acetate

Product Categories

TRC, Hormones, Impurity Reference Materials , Hormones, Steroids and derivatives, Hormones, Steroids and derivatives

Product Type

Impurity, Metabolite, Excipient

Drug Type

Steroids / Hormones

Documentation

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Product Information

Chemical Data

Analyte Name

N-Desmethyl Ulipristal Acetate

CAS Number

159681-66-0

Molecular Formula

C29 H35 N O4

Molecular Weight

461.59

Accurate Mass

461.2566

SMILES

CNc1ccc(cc1)[C@H]2C[C@@]3(C)[C@@H](CC[C@]3(OC(=O)C)C(=O)C)[C@@H]4CCC5=CC(=O)CCC5=C24

InChI

InChI=1S/C29H35NO4/c1-17(31)29(34-18(2)32)14-13-26-24-11-7-20-15-22(33)10-12-23(20)27(24)25(16-28(26,29)3)19-5-8-21(30-4)9-6-19/h5-6,8-9,15,24-26,30H,7,10-14,16H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1

IUPAC

[(8S,11R,13S,14S,17R)-17-acetyl-13-methyl-11-[4-(methylamino)phenyl]-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Ulipristal; Ulipristal Acetate

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N-Desmethyl Ulipristal Acetate

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