Tauro 1-hydroxycholic acid
TL;DR: Tauro 1-hydroxycholic acid (CAS 142608-64-8) is a chemical compound with molecular formula C26H45NO8S and molecular weight 531.28656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(4R)-4-[(1R,3S,5S,7R,10S,13R,17R)-1,3,7,14-tetrahydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
Also Known As: Tauro-CA-1beta-ol, Tauro 1-hydroxycholic Acid, Tauro-1-hydroxycholic acid, 1,3,7,14-Tetrahydroxy-N-(2-sulfoethyl)cholan-24-imidic acid, (8xi,9xi,14xi)-1beta,3alpha,7alpha,14-Tetrahydroxy-N-(2-sulfoethyl)-5beta-cholan-24-imidic acid
Technical Specifications
| Molecular Formula | C26H45NO8S |
| Molecular Weight | 531.28656 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 173.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 531.28656 Da |
| Heavy Atoms | 36 |
| Complexity | 939.0 |
| SMILES | C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CCC2([C@@]1(CCC3C2[C@@H](C[C@H]4[C@@]3([C@@H](C[C@H](C4)O)O)C)O)C)O |
| InChIKey | ZZBPROOCQLCTDL-OMVCMMTCSA-N |
Chemical Property Profile of Tauro 1-hydroxycholic acid
Property Insights of Tauro 1-hydroxycholic acid
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tauro 1-hydroxycholic acid. The TPSA of 173.0 Ų indicates high polarity, suggesting Tauro 1-hydroxycholic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tauro 1-hydroxycholic acid has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tauro 1-hydroxycholic acid?
The CAS number of Tauro 1-hydroxycholic acid is 142608-64-8.
What is the molecular formula of Tauro 1-hydroxycholic acid?
The molecular formula of Tauro 1-hydroxycholic acid is C26H45NO8S.
What is the molecular weight of Tauro 1-hydroxycholic acid?
The molecular weight of Tauro 1-hydroxycholic acid is 531.28656 g/mol.
Where can I buy Tauro 1-hydroxycholic acid?
You can request a quote for Tauro 1-hydroxycholic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tauro 1-hydroxycholic acid?
Yes, CoreyChem provides custom synthesis services for Tauro 1-hydroxycholic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.