3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid

Product Name: 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid
CAS No.: 2458-08-4
Chemical Name: 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid
Synonyms: Einecs 219-542-6;12-Oxocholic acid;Ursodiol Impurity;Cholic Acid Impurity 16;1,3-dimethyl-38-nitrosourea;12-Ketochenodeoxycholic acid;Ursodeoxycholic Acid Impurity 23;Chenodeoxycholic Acid Impurity 10;3,7-Dihydroxy-12-oxocholanoic acid;3α,7α-Dihydroxy-12-oxocholanic acid
CBNumber: CB6890359
Molecular Formula: C24H38O5
Formula Weight: 406.56
MOL File: 2458-08-4.mol

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3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid Property

Boiling point:: 583℃[at 101 325 Pa]
Density: 1.18[at 20℃]
vapor pressure: 0Pa at 20℃
storage temp.: -20°C
solubility: Chloroform: Slightly Soluble
Methanol: Slightly Soluble
pka: 5[at 20 ℃]
form: Solid
color: White to off-white
Water Solubility: 4.698mg/L at 25℃
LogP: 2.97 at 20℃

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P321Specific treatment (see … on this label).

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P362Take off contaminated clothing and wash before reuse.

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N-Bromosuccinimide Price

American Custom Chemicals Corporation

Product number: SHG0020695
Product name: KETOCHOLANIC ACID
Purity: 95.00%
Packaging: 5MG
Price: $459.63
Updated: 2021/12/16

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3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid Chemical Properties,Usage,Production

Uses

12-Ketochenodeoxycholic acid 12 is a direct precursor of cholodeoxycholic acid (CDCA). Cholodeoxycholic acid is used to cholesterol gallstones and has chemotherapeutic properties that dissolve gallstones[1].

Definition

ChEBI: 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanic acid is an oxo-5beta-cholanic acid. It is a conjugate acid of a 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholanate.

Flammability and Explosibility

Non flammable

References

[1] Sawada, H. et al. Microbial production of chenodeoxycholic acid precursor, 12-ketochenodeoxycholic acid, from dehydrocholic acid. European Journal of Applied Microbiology and Biotechnology, 10(1–2), 107–112.
[2] J D SUTHERLAND T P F I A Macdonald. The enzymic and chemical synthesis of ursodeoxycholic and chenodeoxycholic acid from cholic acid.[J]. Preparative biochemistry, 1982, 12 4: 307-321. DOI: 10.1080/00327488208065679
[3] A. HOFMANN. The Preparation of Chenodeoxycholic Acid and Its Glycine and Taurine Conjugates.[J]. Acta chemica Scandinavica, 1963, 177 1: 173-186. DOI: 10.3891/acta.chem.scand.17-0173
[4] AIHUA ZHAO. Increased levels of conjugated bile acids are associated with human bile reflux gastritis.[J]. Scientific Reports, 2020: 11601. DOI: 10.1038/s41598-020-68393-5
[5] YIZHONG WANG. Altered gut microbiota and microbial metabolism in children with hepatic glycogen storage disease: a case-control study.[J]. Translational pediatrics, 2023, 12 4: 572-586. DOI: 10.21037/tp-22-293
[6] MOMIR MIKOV. 3Alpha,7alpha-dihydroxy-12-oxo-5beta-cholanate as blood-brain barrier permeator.[J]. Polish journal of pharmacology, 2004, 56 3: 367-371.
[7] MIHALJ POSA. Effect of cholic acid and its keto derivatives on the analgesic action of lidocaine and associated biochemical parameters in rats.[J]. European Journal of Drug Metabolism and Pharmacokinetics, 2007, 32 2: 109-117. DOI: 10.1007/bf03190999

3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid Suppliers

China 49 India 1 United States 2 Global 52

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2458-08-4, 3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acidRelated Search:

1β,3α,7β-Trihydroxy-5β-cholanic Acid Ursodeoxycholic acid EP Impurity M Chenodeoxycholic acid 4-[(5S,7S,8S,10S,13R,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 (4R)-4-[(3R,5R,8R,9S,10S,12R,13R,14S,17R)-3,12-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 URSODEOXYCHOLIC-2,2,4,4-D4 ACID Deoxyursocholic acid methyl ester (5a,7b)-7-hydroxy-3-oxo-Cholan-24-oic acid 7-Oxyisotithocholic Acid 3alpha-Hydroxy-7-oxo-5beta-cholanic Acid LITHOCHOLIC ACID 3,7-DIKETO-5BETA-CHOLAN-24-OIC ACID (3a,5b,7a,12b)-3,7,12-trihydroxy-Cholan-24-oic acid Ursodeoxycholic acid (3α,5β,7β)- 3,7,22-Trihydroxycholan-24-oic Acid α-Muricholic Acid (3b,5b,7a,12a)-3,7,12-trihydroxy-Cholan-24-oic acid (4R)-4-[(3S,5S,7S,8S,9S,10R,13R,14S,17R)-3,7-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

3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid

3,7-Dihydroxy-12-oxocholanoic acid

12-Ketochenodeoxycholic acid

12-Oxocholic acid

3α,7α-Dihydroxy-12-oxocholanic acid

Cholan-24-oic acid, 3,7-dihydroxy-12-oxo-, (3 alpha,5 beta,7 alpha)-

Einecs 219-542-6

Chenodeoxycholic Acid Impurity 10

Cholic Acid Impurity 8 (12-Oxochenodeoxycholic Acid)

5β-CHOLANIC acid-3α, 7α-DIOL-12-ONE

Ursodeoxycholic Acid Impurity 23

Cholan-24-oic acid,3,7-dihydroxy-12-oxo-, (3a,5b,7a)-

3α,7α-dihydroxy-12-oxo-5β-cholanic acid

Cholic Acid Impurity 16

Chenodeoxycholic Acid EP Impurity H

(R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid

3-a,7-a-dihydroxy-12-0x0-53-cholan-24-oic acid

1,3-dimethyl-38-nitrosourea

Chenodeoxycholic Acid EP Impurity H (12-Oxochenodeoxycholic Acid)

Ursodiol Impurity

3α,7α-dihydroxy-12-oxo-5β-cholan-24-oic acid

3α,7α-Dihydroxy-12-Ketocholanic Acid

(3ALPHA,5BETA,7ALPHA)-3,7-DIHYDROXY-12-OXOCHOLAN-24-OIC ACID

2458-08-4