| Primary information |
|---|
| ID | 20229 |
| Pubchem ID | 3034759 |
| Name | Tauroursodeoxycholic acid |
| Description | RN given refers to (3alpha;5beta;7beta)-isomer |
| Synonym | Ursodeoxycholyltaurine Tauroursodeoxycholic acid TUDCA Tauroursodeoxycholic acid (6CI;7CI) tauroursodeoxycholic acid; (3alpha;5alpha;7alpha)-isomer |
| Molecular Weight | 499.7 |
| Formula | C26H45NO6S |
| IUPAC | 2-[[(4R)-4-[(3R;5S;7S;10S;13R;17R)-3;7-dihydroxy-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]ethanesulfonic acid |
| SMILE | CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C |
| PDB ID | NA |
| KEGG | NA |
| HMDB ID | HMDB0000874 |
| Melting Point (Degree C) | NA |
| Water Solubility | NA |
| Drugbank ID | NA |
| Receptor | NA |
| Reference | HMDB
|