Lithocholylglycine
| Catalog Number | BL-M000506 |
| CAS Number | 474-74-8 |
| Description | Lithocholylglycine is a metabolite found in human hepatic bile. Lithocholylglycine is also a lithocholic acid analog that has been used to inhibit sialyltransferase. |
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| IUPAC Name | 2-[[(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid |
| Synonyms | Glycolithocholic acid; Glycolithocholate; Lithocholic acid glycine conjugate; N-((3-alpha,5-beta)-3-Hydroxy-24-oxocholan-24-yl)glycine; N-(3a-hydroxy-5b-cholan-24-oyl)-Glycine; N-[(3α,5β)-3-Ηydroxy-24-oxocholan-24-yl]glycine |
| Molecular Weight | 433.63 |
| Molecular Formula | C26H43NO4 |
| Boiling Point | 619.7°C at 760 mmHg |
| Melting Point | 176-178°C |
| Purity | >99% |
| Appearance | Powder |
| Application | A metabolite in human hepatic bile. |
| Shelf Life | 1 Year |
| Storage | Store at -20°C |
| Percent Composition | C 72.02%, H 10.00%, N 3.23%, O 14.76% |
| Canonical SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C |
| InChI | InChI=1S/C26H43NO4/c1-16(4-9-23(29)27-15-24(30)31)20-7-8-21-19-6-5-17-14-18(28)10-12-25(17,2)22(19)11-13-26(20,21)3/h16-22,28H,4-15H2,1-3H3,(H,27,29)(H,30,31)/t16-,17-,18-,19+,20-,21+,22+,25+,26-/m1/s1 |
| InChI Key | XBSQTYHEGZTYJE-OETIFKLTSA-N |
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