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Product Overview

Product Code

TRC-O856895

CAS Number

2304-89-4

Product Format

Neat

Molecular Formula

C23 H36 O6

Molecular Weight

408.53

API Family

Cholic Acid

Product Categories

TRC, Lipids, Lipids

Product Type

Bioactive Small Molecule

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

3-Oxo-7alpha,12alpha-hydroxy-5beta-cholanoic Acid

CAS Number

2304-89-4

Molecular Formula

C23 H36 O6

Molecular Weight

408.53

Accurate Mass

408.2512

SMILES

O[C@H]1[C@]2([C@]3([C@@](C)([C@@]([C@@H](CCC(O)=O)C)(CC3)[H])[C@@H](O)C[C@@]2([C@]4(C)[C@](C1)(CC(=O)CC4)[H])[H])[H])[H]

InChI

InChI=1S/C23H36O6/c1-22-8-7-13(24)9-12(22)10-18(26)21-15-4-3-14(17(25)5-6-20(28)29)23(15,2)19(27)11-16(21)22/h12,14-19,21,25-27H,3-11H2,1-2H3,(H,28,29)/t12-,14+,15-,16-,17+,18+,19-,21-,22-,23+/m0/s1

IUPAC

(4R)-4-[(5R,7R,8R,9S,10S,12S,13S,14S,17S)-7,12-dihydroxy-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-4-hydroxybutanoic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Cholic Acid

Purity

>95% (HPLC)

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