3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE

Modify Date: 2024-04-03 12:52:18

3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure
3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE structure
Common Name 3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE
CAS Number 2616-79-7 Molecular Weight 446.62
Density 1.1g/cm3 Boiling Point 516.8ºC at 760 mmHg
Molecular Formula C27H42O5 Melting Point N/A
MSDS USA Flash Point 217.8ºC

 Use of 3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE


Methyl (3α,5α)-3-(acetyloxy)-6-oxocholan-24-oate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.

 Names

Name methyl (4R)-4-[(3R,5S,8S,9S,10R,13R,14S,17R)-3-acetyloxy-10,13-dimethyl-6-oxo-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
Synonym More Synonyms

  Biological Activity

Description Methyl (3α,5α)-3-(acetyloxy)-6-oxocholan-24-oate is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog

 Chemical & Physical Properties

Density 1.1g/cm3
Boiling Point 516.8ºC at 760 mmHg
Molecular Formula C27H42O5
Molecular Weight 446.62
Flash Point 217.8ºC
Exact Mass 446.30300
PSA 69.67000
LogP 5.34530
Vapour Pressure 8.68E-11mmHg at 25°C
Index of Refraction 1.519

 Safety Information

Personal Protective Equipment Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADR NONH for all modes of transport
WGK Germany 3

 Synthetic Route

~92%

3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: SAGE THERAPEUTICS, INC.; UPASANI, Ravindra, B.; HARRISON, Boyd, L.; ASKEW, Benny, C. Jr.; DODART, Jean-Cosme; SALITURO, Francesco, G.; ROBICHAUD, Albert, J. Patent: WO2013/36835 A1, 2013 ; Location in patent: Page/Page column 178; 179; 180 ;

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3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: SAGE THERAPEUTICS, INC.; UPASANI, Ravindra, B.; HARRISON, Boyd, L.; ASKEW, Benny, C. Jr.; DODART, Jean-Cosme; SALITURO, Francesco, G.; ROBICHAUD, Albert, J. Patent: WO2013/36835 A1, 2013 ;

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3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: SAGE THERAPEUTICS, INC.; UPASANI, Ravindra, B.; HARRISON, Boyd, L.; ASKEW, Benny, C. Jr.; DODART, Jean-Cosme; SALITURO, Francesco, G.; ROBICHAUD, Albert, J. Patent: WO2013/36835 A1, 2013 ;

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3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: SAGE THERAPEUTICS, INC.; UPASANI, Ravindra, B.; HARRISON, Boyd, L.; ASKEW, Benny, C. Jr.; DODART, Jean-Cosme; SALITURO, Francesco, G.; ROBICHAUD, Albert, J. Patent: WO2013/36835 A1, 2013 ;

~%

3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: Fernholz Hoppe-Seyler's Zeitschrift fuer Physiologische Chemie, 1935 , vol. 232, p. 202,204

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3-ALPHA-HYDROXY-6-OXO-5-ALPHA-CHOLAN-24-OIC ACID METHYL ESTER 3-ACETATE Structure

3-ALPHA-HYDROXY...

CAS#:2616-79-7

Literature: Hoehn; Linsk; Moffett Journal of the American Chemical Society, 1946 , vol. 68, p. 1855

 Synonyms

3alpha-Hydroxy-6-oxo-5alpha-cholan-24-oic acid methyl ester 3-acetate
Methyl 3|A-acetoxy-6-oxo-5|A-cholanate
5|A-Cholanic acid-3|A-ol-6-one 3-acetate methyl ester
3|A-Hydroxy-6-oxo-5|A-cholan-24-oic acid methyl ester 3-acetate
5alpha-Cholanic acid-3alpha-ol-6-one 3-acetate methyl ester
Methyl 3alpha-acetoxy-6-oxo-5alpha-cholanate