(E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-… 1516887-33-4

About (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid

(E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid is a metabolite or degradation product of Obeticholic Acid carrying the CAS registry number 1516887-33-4. The compound has the formula C26H40O4, corresponding to a molecular weight of 416.6 g/mol.

The product is provided as a solid. Reference materials should be stored sealed and away from light and moisture, as specified on the accompanying COA. The GHS classification uses the signal word “Warning”, so appropriate gloves, eye protection and ventilation are recommended.

It is used in metabolite identification, stability-indicating method development and impurity profiling of Obeticholic Acid, as well as in QC testing and ANDA/DMF documentation. It is used across pharmaceutical manufacturing and academic and industrial research.

We offer (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid in 10 mg, 25 mg, 50 mg and 100 mg packs with a batch-specific COA, and ship to customers worldwide.

Typical applications

Metabolite identification
Stability-indicating methods
Impurity profiling

Industries

Related to Obeticholic Acid

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

Obeticholic Acid impurities

Specifications & identifiers

Chemical identifiers
Product name	(E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid
Catalogue No.	VQ-026972
CAS Number	1516887-33-4
IUPAC name	(4R)-4-[(3R,5R,6E,8S,9S,10R,13R,14S,17R)-6-ethylidene-3-hydroxy-10,13-dimethyl-7-oxo-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Molecular formula	C₂₆H₄₀O₄
Molecular weight	416.6 g/mol
Exact mass	416.2927
Grade	Reference Standard
HSN code	38229090
InChIKey	RDCBMNFSJFALPG-VRYJCBLKSA-N
SMILES	C/C=C/1\[C@@H]2C[C@@H](CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3C1=O)CC[C@@H]4[C@H](C)CCC(=O)O)C)C)O
PubChem CID	86706183

Physical properties
Physical form	Solid
LogP (XLogP3)	5.3
H-bond donors / acceptors	2 / 4
TPSA	74.6 Å²

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H302Harmful if swallowed
H332Harmful if inhaled

Precautionary statements: P261, P264, P270, P271, P301 + P317, P304 + P340, P317, P330, P501

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 (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid?

The CAS Registry Number of (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid is 1516887-33-4. It is also known as (E)-3a-hydroxy-6-ethylidene-7-keto-5β-cholan-24-oic acid, (E)-3α-Hydroxy-6-ethylidene-7-keto-5β-cholan-24-oic Acid.

What is the molecular formula and molecular weight of (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid?

(E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid has the molecular formula C26H40O4 and a molecular weight of 416.6 g/mol.

What is (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid used for?

(E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid is supplied as a characterised reference material related to Obeticholic 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 (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid can I order?

We supply (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic 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 (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid?

Yes. Every lot of (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic 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 (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic Acid be shipped internationally?

Yes. (E)-3alpha-Hydroxy-6-ethylidene-7-keto-5beta-cholan-24-oic 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.