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3057-04-3

3057-04-3 Structure

3057-04-3 Structure
IdentificationBack Directory
[Name]

METHYL CHENODEOXYCHOLATE
[CAS]

3057-04-3
[Synonyms]

CDCA-ME
Methyl chenodoxycholate
METHYL CHENODEOXYCHOLATE
Chenodeoxycholic acid methyl
Obeticholic Acid Impurity 41
CHENODEOXYCHOLIC ACID METHYL ESTER
Urosodeoxycholic Acid EP Impurity O
Methyl 3α,7α-Dihydroxy-5β-cholanoate
Methyl 3α,7α-Dihydroxy-5β-cholan-24-oate
3α,7α-Diol-5β-24-cholanoic acid methyl ester
5-BETA-CHOLANIC ACID-3-ALPHA, 7-ALPHA-DIOL METHYL ESTER
(3α,5β,7α)-3,7-Dihydroxy-cholan-24-oic Acid Methyl Ester
Methyl chenodeoxycholate/Chenodeoxycholic acid methyl ester
Cholan-24-oic acid, 3,7-dihydroxy-, methyl ester, (3α,5β,7α)-
methyl (4R)-4-[(5S,7R,8R,9S,10S,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]pentanoate
(4R)-4-[(5S,7R,8R,9S,10S,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]valeric acid methyl ester
[Molecular Formula]

C25H42O4
[MDL Number]

MFCD00232923
[MOL File]

3057-04-3.mol
[Molecular Weight]

406.6
Chemical PropertiesBack Directory
[Melting point ]

85-94 °C
[Boiling point ]

507.6±25.0 °C(Predicted)
[density ]

1.089±0.06 g/cm3(Predicted)
[storage temp. ]

Refrigerator
[solubility ]

Chloroform (Slightly), DMSO (Slightly), Methanol
[form ]

Solid
[pka]

14.79±0.70(Predicted)
[color ]

White to Pale Yellow
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

A bile acid with hemolytic properties. Inhibits the initiation of Clostridium difficile spore germination. Anti-inflamatiory activity.
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