ChemicalBook > CAS DataBase List > (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid

(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid

Product Name
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
CAS No.
5130-29-0
Chemical Name
(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
Synonyms
Cholic Acid Impurity 9;12-Ketodeoxycholic acid;5β-CHOLANIC ACID-3α-OL-12-ONE;5β-CHOLANIC acid-3α-OL-12-ONE;3-ALPHA-HYDROXY-12-OXO-5-BETA-CHOLANOICACID;Cholan-24-oic acid, 3-hydroxy-12-oxo-, (3α,5β)-;Cholic Acid IMpurity (3-alpha-Hydroxy-12-Oxo-5-beta-Cholanoic Acid);(4R)-4-((3R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid;(R)-4-((3R,5R,8R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid;(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
CBNumber
CB51235330
Molecular Formula
C24H38O4
Formula Weight
390.56
MOL File
5130-29-0.mol
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(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid Property

Melting point:
165-167 °C
Boiling point:
545.9±35.0 °C(Predicted)
Density 
1.124±0.06 g/cm3(Predicted)
storage temp. 
Store at -20°C
solubility 
DMF: 30 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml,Ethanol:PBS (pH 7.2) (1:3): 0.25 mg/ml
form 
A solid
pka
4.74±0.10(Predicted)
color 
White to off-white
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
SMB00913
Product name
BAA485 (12-Ketodeoxycholic acid)
Purity
≥95% (HPLC)
Packaging
25MG
Price
$213
Updated
2023/06/20
Cayman Chemical
Product number
29547
Product name
12-keto Lithocholic Acid
Packaging
5mg
Price
$78
Updated
2024/03/01
Cayman Chemical
Product number
29547
Product name
12-keto Lithocholic Acid
Packaging
50mg
Price
$388
Updated
2024/03/01
Cayman Chemical
Product number
29547
Product name
12-keto Lithocholic Acid
Packaging
10mg
Price
$124
Updated
2024/03/01
Cayman Chemical
Product number
29547
Product name
12-keto Lithocholic Acid
Packaging
25mg
Price
$214
Updated
2024/03/01
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(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid Chemical Properties,Usage,Production

Description

12-keto Lithocholic acid is a metabolite of the secondary bile acid deoxycholic acid (DCA; Item Nos. 20756 | 18231). Fecal levels of 12-keto lithocholic acid are elevated in rats fed a diet supplemented with cholic acid or DCA compared with rats fed a control diet or a diet supplemented with cholesterol , hyodeoxycholic acid (HDCA; ), or lithocholic acid (LCA; ). 12-keto Lithocholic acid activates the human pregnane X receptor (PXR; EC50 = 31.3 μM in a cell-based transactivation assay). 12-keto Lithocholic acid levels are increased in duodenal bile from patients with type 2 diabetes.

Definition

ChEBI: 12-ketolithocholic acid is a bile acid.

(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid Suppliers

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TargetMol Chemicals Inc.
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TargetMol Chemicals Inc.
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Cayman Chemical Company
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View Lastest Price from (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid manufacturers

Henan Aochuang Chemical Co.,Ltd.
Product
12-Ketodeoxycholic acid 5130-29-0
Price
US $0.00-0.00/kg
Min. Order
1kg
Purity
98%
Supply Ability
1Ton
Release date
2022-10-10

5130-29-0, (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acidRelated Search:

Butyrylcholinesterase Obeticholic Acid

  • (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
  • 12-Ketodeoxycholic acid
  • 3-ALPHA-HYDROXY-12-OXO-5-BETA-CHOLANOICACID
  • Cholic Acid IMpurity (3-alpha-Hydroxy-12-Oxo-5-beta-Cholanoic Acid)
  • (4R)-4-((3R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
  • Cholic Acid Impurity 9
  • 5β-CHOLANIC acid-3α-OL-12-ONE
  • (R)-4-((3R,5R,8R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethyl-12-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic acid
  • acid,chronic,12Ketodeoxycholic acid,kidney,12 Ketodeoxycholic acid,Inhibitor,injury,NAFLD,Aristolochic,nephropathy,inhibit,Endogenous Metabolite,AAN,disease,12-Ketodeoxycholic acid
  • Cholan-24-oic acid, 3-hydroxy-12-oxo-, (3α,5β)-
  • 5β-CHOLANIC ACID-3α-OL-12-ONE
  • 5130-29-0