Glycocholic acid
| Catalog Number | BL-M000503 |
| CAS Number | 475-31-0 |
| Description | Glycocholic acid is a bile acid glycine conjugate having cholic acid as the bile acid component. It has a role as a human metabolite. It derives from a cholic acid and a glycochenodeoxycholic acid. It is a conjugate acid of a glycocholate. |
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| IUPAC Name | 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 | Cholylglycine hydrate; N-[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl]glycine; 3α,7α,12α-Trihydroxy-5β-cholan-24-oylglycine; 3α,7α,12α-Trihydroxy-5β-cholanic acid-24-glycine; 3α,7α,12α-Trihydroxy-N-(carboxymethyl)-5β-cholan-24-amide; Cholylglycine; Glycine Cholate; N-Choloylglycine; 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 |
| Molecular Weight | 465.63 |
| Molecular Formula | C26H43NO6 |
| Boiling Point | 692.0 °C at 760 mmHg |
| Melting Point | 128 °C |
| Purity | ≥ 99% (HPLC) |
| Density | 1.134 g/cm3 (Predicted) |
| Solubility | Soluble in Ethanol |
| Appearance | White to Off-White Solid |
| Application | Labelled Glycocholic Acid. The product of conjugation of cholic acid with glycine; chief ingredient of the bile of herbivorous animals. In the weakly alkaline bile fluid glycocholic acid exists as the sodium salt. |
| Shelf Life | 1 Year |
| Storage | Store at -20°C |
| Percent Composition | C 67.07%, H 9.31%, N 3.01%, O 20.62% |
| Canonical SMILES | CC(CCC(=O)NCC(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C |
| InChI | InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1 |
| InChI Key | RFDAIACWWDREDC-FRVQLJSFSA-N |
※ Please be kindly noted products are not for therapeutic use. We do not sell to patients.
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