ChemicalBook--->CAS DataBase List--->1199796-29-6

1199796-29-6

1199796-29-6 Structure

1199796-29-6 Structure
IdentificationBack Directory
[Name]

S-EMCA
[CAS]

1199796-29-6
[Synonyms]

S-EMCA
INT-777
CS-1212
INT-777, S-EMCA
6a-Ethyl-23(S)-methylcholic acid
6α-Ethyl-23(S)-Methylcholic acid
6alpha-Ethyl-23(S)-methylcholic acid
Cholane-23-carboxylic acid, 6-ethyl-3,7,12-trihydroxy-, (3α,5β,6α,7α,12α,23S)-
[Molecular Formula]

C27H46O5
[MDL Number]

MFCD18837028
[MOL File]

1199796-29-6.mol
[Molecular Weight]

450.651
Chemical PropertiesBack Directory
[Melting point ]

150-152℃
[Boiling point ]

602.8±55.0 °C(Predicted)
[density ]

1.128±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF:30.0(Max Conc. mg/mL);66.57(Max Conc. mM)
DMF:PBS (pH 7.2) (1:1):0.5(Max Conc. mg/mL);1.11(Max Conc. mM)
DMSO:25.5(Max Conc. mg/mL);56.58(Max Conc. mM)
Ethanol:37.5(Max Conc. mg/mL);83.21(Max Conc. mM)
[form ]

Powder
[pka]

4.80±0.21(Predicted)
[color ]

White to yellow
Hazard InformationBack Directory
[Uses]

INT 777 is an inhibitor of TGR5 receptor, which is a transmembrane G protein-coupled receptor expressed in brown adipose tissue and muscle and activated by bile acid.
[in vivo]

INT-777 (1 μM/min/kg, p.o.) has a potent choleretic effect, prevents carboxyl CoA activation and subsequent conjugation, thereby favoring its chole-hepatic shunt pathway with a ductular absorption and a potent choleretic effect in HF-fed TGR5-Tg male mice[1]. INT-777 (30 mg/kg/day, p.o.) increases energy expenditure and reduces hepatic steatosis and obesity upon high-fat feeding in TGR5-Tg mice[2].

[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

S-EMCA(1199796-29-6)1HNMR
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