| Identification | Back Directory | [Name]
2-((4R)-4-((3R,5R,6S,7R,10R,13R)-3,6,7-Trihydroxy-10,13-Dimethylhexadecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanamido)Acetic Acid | [CAS]
66225-78-3 | [Synonyms]
Gly-β-MCA
Glyco-?-Muricholic Acid
Glycine--Muricholic Acid
Glycine-β-muricholic Acid
Glycine-β-muricholic acid (GβMCA)
N-[(3α,5β,6β,7β)-3,6,7-Trihydroxy-24-oxocholan-24-yl]glycine
2-((4R)-4-((3R,5R,6S,7R,10R,13R)-3,6,7-Trihydroxy-10,13-Dimethylhexadecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanamido)Acetic Acid
2-((4R)-4-((3R,5R,6S,7R,10R,13R)-3,6,7-Trihydroxy-10,13-Dimethylhexadecahydro-1H-Cyclopenta[A]Phenanthren-17-Yl)Pentanamido)Acetic Acid(WXC04817) | [Molecular Formula]
C26H43NO6 | [MOL File]
66225-78-3.mol | [Molecular Weight]
465.62 |
| Chemical Properties | Back Directory | [Boiling point ]
673.4±55.0 °C(Predicted) | [density ]
1.213±0.06 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMF: 30 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 20 mg/ml; Ethanol: 20 mg/ml | [form ]
A crystalline solid | [pka]
3.58±0.10(Predicted) | [color ]
White to off-white | [InChIKey]
ZQYUKJFJPJDMMR-IIWZPVADSA-N | [SMILES]
[H][C@@]12[C@]([C@](CC[C@@H](O)C3)(C)[C@]3([H])[C@H](O)[C@@H]2O)([H])CC[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(NCC(O)=O)=O |
| Hazard Information | Back Directory | [Uses]
Gly-β-MCA, a bile acid, is a potent, sable, intestine-selective and oral bioactive farnesoid X receptor (FXR) inhibitor that may be a candidate for the treatment of metabolic disorders[1]. | [in vivo]
Gly-β-MCA (Gly-MCA, p.o. 10 and 50 mg/kg) prevents and treats diet-induced and genetic obesity, along with insulin resistance and hepatic steatosis without systemic, hepatic or intestinal toxicities in mice[1].
Gly-MCA does not increase faecal LCN-2 levels, indicating that Gly-MCA does not induce intestinal inflammation[1]. | [storage]
Store at -20°C | [References]
[1] Jiang C, et al. Intestine-selective farnesoid X receptor inhibition improves obesity-related metabolic dysfunction. Nat Commun. 2015 Dec 15;6:10166. DOI:10.1038/ncomms10166 |
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