Isodeoxycholic acid

Name: Isodeoxycholic acid
Brand: Vaqora Chemicals
SKU: VQ-036281

About Isodeoxycholic acid

Isodeoxycholic acid (CAS 566-17-6) is a process intermediate or related compound of Ursodeoxycholic offered by Vaqora Chemicals. The compound has the formula C24H40O4, corresponding to a molecular weight of 392.6 g/mol. Alternative names: 3-Deoxycholic acid and 5-beta-cholanic acid-7-alpha, 12-alpha-diol.

It is supplied as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. Good laboratory practice and suitable PPE are recommended during handling.

It is a process intermediate or related compound in the synthesis of Ursodeoxycholic, useful for route development, impurity fate-and-purge studies and analytical method development. Our customers for this product work in pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies Isodeoxycholic acid in 10 mg, 25 mg, 50 mg and 100 mg packs, each shipped with a Certificate of Analysis (COA), and exports worldwide.

Typical applications

API route development
Impurity fate & purge studies
Analytical method development
Fine chemical synthesis

Industries

Related to Ursodeoxycholic

View every impurity, metabolite and intermediate we list for Ursodeoxycholic.

Ursodeoxycholic impurities

Specifications & identifiers

Chemical identifiers
Product name	Isodeoxycholic acid
Catalogue No.	VQ-036281
CAS Number	566-17-6
IUPAC name	(4R)-4-[(5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-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
Molecular formula	C₂₄H₄₀O₄
Molecular weight	392.6 g/mol
Exact mass	392.2927
InChIKey	ZHCAAZIHTDCFJX-QLEQUTGBSA-N
SMILES	C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CCCC4)C)O)O)C
PubChem CID	164672

Physical properties
Physical form	Solid
LogP (XLogP3)	5.3
H-bond donors / acceptors	3 / 4
TPSA	77.8 Å²
Synonyms	7alpha,12alpha-Dihydroxy-5beta-cholan-24-oic Acid, 3-Deoxycholic acid, 5-beta-cholanic acid-7-alpha, 12-alpha-diol, 7alpha,12alpha-Dihydroxy-5beta-cholanic acid, Cholan-24-oic acid, 7,12-dihydroxy-, (5beta,7alpha,12alpha)-, 7alpha,12alpha-Dihydroxycholanoic acid, 7, A,12, A-Dihydroxy-5, A-cholan-24-oic Acid, 3-deoxy Cholic Acid, 7a,12a-Dihydroxycholanoate

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of Isodeoxycholic acid?

The CAS Registry Number of Isodeoxycholic acid is 566-17-6. It is also known as 7alpha,12alpha-Dihydroxy-5beta-cholan-24-oic Acid, 3-Deoxycholic acid, 5-beta-cholanic acid-7-alpha, 12-alpha-diol.

What is the molecular formula and molecular weight of Isodeoxycholic acid?

Isodeoxycholic acid has the molecular formula C24H40O4 and a molecular weight of 392.6 g/mol.

What is Isodeoxycholic acid used for?

Isodeoxycholic acid is supplied as a characterised reference material related to Ursodeoxycholic. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of Isodeoxycholic acid can I order?

We supply Isodeoxycholic acid, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with Isodeoxycholic acid?

Yes. Every lot of Isodeoxycholic acid is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can Isodeoxycholic acid be shipped internationally?

Yes. We export Isodeoxycholic acid worldwide by air and sea freight or express courier, on EXW, FOB, CIF, CFR or DAP Incoterms, with full export documentation.