ChemicalBook >> CAS DataBase List >>3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid

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
12-Oxocholic acid;12-Ketochenodeoxycholic acid;Einecs 219-542-6;Ursodiol Impurity;Cholic Acid Impurity 16;1,3-dimethyl-38-nitrosourea;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
Molecular Weight:
406.56
MDL Number:
MFCD00134876
MOL File:
2458-08-4.mol
MSDS File:
SDS
Last updated:2026-05-28 03:25:53
Product description Number Pack Size Price
12-keto Chenodeoxycholic Acid ≥95% 30838 1mg $32
12-keto Chenodeoxycholic Acid ≥95% 30838 5mg $145
12-keto Chenodeoxycholic Acid ≥95% 30838 10mg $256
12-keto Chenodeoxycholic Acid ≥95% 30838 25mg $559
(3a,5b,7a)-3,7-Dihydroxy-12-oxo-cholan-24-oic acid CAA45808 2mg $150
More product size

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

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℃
FDA UNII 3MKE33N44O
UNSPSC Code 12352211
NACRES NA.25

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H319-H315
Precautionary statements  P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
REACH Registrations Active

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

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Cayman Chemical 30838 12-keto Chenodeoxycholic Acid ≥95% 2458-08-4 1mg $32 2026-04-30 Buy
Cayman Chemical 30838 12-keto Chenodeoxycholic Acid ≥95% 2458-08-4 5mg $145 2026-04-30 Buy
Cayman Chemical 30838 12-keto Chenodeoxycholic Acid ≥95% 2458-08-4 10mg $256 2026-04-30 Buy
Cayman Chemical 30838 12-keto Chenodeoxycholic Acid ≥95% 2458-08-4 25mg $559 2026-04-30 Buy
Biosynth CAA45808 (3a,5b,7a)-3,7-Dihydroxy-12-oxo-cholan-24-oic acid 2458-08-4 2mg $150 2026-06-04 Buy
Product number Packaging Price Buy
30838 1mg $32 Buy
30838 5mg $145 Buy
30838 10mg $256 Buy
30838 25mg $559 Buy
CAA45808 2mg $150 Buy

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

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3alpha,7alpha-dihydroxy-12-oxo-5beta-cholan-24-oic acid 3,7-Dihydroxy-12-oxocholanoic 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 12-Ketochenodeoxycholic acid (Standard) 12-Ketochenodeoxycholic acid 12-Oxocholic acid 2458-08-4