3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid

Name: 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid
Brand: Vaqora Chemicals
SKU: VQ-029739

About 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid

3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid is a metabolite or degradation product of Cholic Acid carrying the CAS registry number 2304-89-4. With the molecular formula C24H38O5, it has a molar mass of 406.6 g/mol. Alternative names: 3-Oxocholic acid and 7,12-Dihydroxy-3-oxocholanic acid.

The product is provided as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. It carries the GHS signal word “Warning” with 1 hazard statement. Review the Safety Data Sheet before use.

It is used in metabolite identification, stability-indicating method development and impurity profiling of Cholic Acid, as well as in QC testing and ANDA/DMF documentation. Typical end-use sectors are pharmaceutical manufacturing and academic and industrial research.

Vaqora Chemicals supplies 3-Oxo-7α,12a-hydroxy-5-β-cholanoic 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

Metabolite identification
Stability-indicating methods
Impurity profiling

Industries

Related to Cholic Acid

View every impurity, metabolite and intermediate we list for Cholic Acid.

Cholic Acid impurities

Specifications & identifiers

Chemical identifiers
Product name	3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid
Catalogue No.	VQ-029739
CAS Number	2304-89-4
IUPAC name	(4R)-4-[(5R,7R,8R,9S,10S,12S,13R,14S,17R)-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]pentanoic acid
Molecular formula	C₂₄H₃₈O₅
Molecular weight	406.6 g/mol
Exact mass	406.2719
Grade	Reference Standard
HSN code	38229090
InChIKey	OEKUSRBIIZNLHZ-DJDNIQJZSA-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(CCC(=O)C4)C)O)O)C
PubChem CID	5283956

Physical properties
Physical form	Solid
LogP (XLogP3)	3.2
H-bond donors / acceptors	3 / 5
TPSA	94.8 Å²
Synonyms	3-Oxocholic acid, 7,12-Dihydroxy-3-oxocholanic acid, 3-oxo-7alpha,12alpha-dihydroxy-5beta-cholan-24-oic acid, Cholan-24-oic acid, 7,12-dihydroxy-3-oxo-, (5beta,7alpha,12alpha)-, 3-Oxo-7a,12a-dihydroxy-5b-cholanic acid, 3-Ketocholic acid, 7alpha,12alpha-Dihydroxy-3-oxo-5beta-cholan-24-oic Acid, 7alpha,12alpha-Dihydroxy-3-oxo-cholanoic acid, 3-dehydrocholic acid, 3-Oxocholate

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H319Causes serious eye irritation

Precautionary statements: P264 + P265, P280, P305 + P351 + P338, P337 + P317

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

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 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid?

The CAS Registry Number of 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid is 2304-89-4. It is also known as 3-Oxocholic acid, 7,12-Dihydroxy-3-oxocholanic acid, 3-oxo-7alpha,12alpha-dihydroxy-5beta-cholan-24-oic acid.

What is the molecular formula and molecular weight of 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid?

3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid has the molecular formula C24H38O5 and a molecular weight of 406.6 g/mol.

What is 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid used for?

3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid is supplied as a characterised reference material related to Cholic Acid. 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 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid can I order?

We supply 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid in Reference Standard grade, 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 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid?

Yes. Every lot of 3-Oxo-7α,12a-hydroxy-5-β-cholanoic 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 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid be shipped internationally?

Yes. 3-Oxo-7α,12a-hydroxy-5-β-cholanoic Acid is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.