Product Information
Name:Methyl Lithocholate
Controlled Product
Synonyms:
- Cholan-24-oic acid
- 3-hydroxy-
- methyl ester
- (3α,5β)-
- 5β-Cholan-24-oic acid
- 3α-hydroxy-
- methyl ester (8CI)
- 5β-Cholanic acid
- 3α-hydroxy-
- methyl ester (6CI,7CI)
- Lithocholic acid methyl ester
- Methyl 3α-hydroxy-5β-cholan-24-oate
- Methyl 3α-hydroxy-5β-cholanoate
- NSC 63558
- See more synonyms
Brand:TRC
Description:Applications Methyl Lithocholate is an derivative of Lithocholic Acid (L469180),a cholic acid derivative as TGR5 modulator. Found in ox bile, human bile, rabbit bile, and in ox and pig gallstones.References Roleira, F.M., et al.: Lett. Drug. Design. Discovery., 7, 610 (2010);
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Chemical properties
Molecular weight:390.60
Formula:C25H42O3
Color/Form:Neat
InChI:InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1
InChI key:InChIKey=YXZVCZUDUJEPPK-GANBIQKCSA-N
SMILES:COC(=O)CC[C@@H](C)C1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
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