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Product Overview

Product Code

TRC-U849900

CAS Number

2955-27-3

EP Description

Ursodeoxycholic Acid EP Impurity D

Product Format

Neat

Molecular Formula

C24 H40 O5

Molecular Weight

408.57

API Family

Cholic Acid, Ursodeoxycholic Acid

Product Categories

TRC, Impurity Reference Materials , Forensic and Toxicology Reference Materials, Bioactive small molecules, Lipids

Product Type

Metabolite, Bioactive Small Molecule

Purity

>95% (HPLC)

Drug Type

Other Drugs & Biomarkers

Documentation

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Product Information

Chemical Data

Analyte Name

Ursocholic Acid

CAS Number

2955-27-3

Molecular Formula

C24 H40 O5

Molecular Weight

408.57

Accurate Mass

408.2876

SMILES

C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C

InChI

InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1

IUPAC

(4R)-4-[(3R,5S,7S,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Cholic Acid; Ursodeoxycholic Acid

Purity

>95% (HPLC)

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