Trityrosine
TL;DR: Trityrosine (CAS 116610-59-4) is a chemical compound with molecular formula C27H29N3O9 and molecular weight 539.19037 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-[3-[5-(2-amino-2-carboxyethyl)-3-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid
Also Known As: Trityrosine, hexaphenylstannane, 3,3',3''-Tertyrosine, m-Terphenyl-3,3'',5'-tripropionic acid, alpha,alpha',alpha''-triamino-2',6',6''-trihydroxy-, 2-amino-3-[3-[5-(2-amino-2-carboxyethyl)-3-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-2-hydroxyphenyl]-4-hydroxyphenyl]propanoic acid
Technical Specifications
| Molecular Formula | C27H29N3O9 |
| Molecular Weight | 539.19037 g/mol |
| XLogP | -5.9 |
| Topological Polar Surface Area (TPSA) | 251.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 11 |
| Exact Mass | 539.19037 Da |
| Heavy Atoms | 39 |
| Complexity | 804.0 |
| SMILES | C1=CC(=C(C=C1CC(C(=O)O)N)C2=CC(=CC(=C2O)C3=C(C=CC(=C3)CC(C(=O)O)N)O)CC(C(=O)O)N)O |
| InChIKey | NPBWIDQFGZURMZ-UHFFFAOYSA-N |
Chemical Property Profile of Trityrosine
Property Insights of Trityrosine
The XLogP value of -5.9 indicates that Trityrosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 251.0 Ų indicates high polarity, suggesting Trityrosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trityrosine has 9 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Trityrosine?
The CAS number of Trityrosine is 116610-59-4.
What is the molecular formula of Trityrosine?
The molecular formula of Trityrosine is C27H29N3O9.
What is the molecular weight of Trityrosine?
The molecular weight of Trityrosine is 539.19037 g/mol.
Where can I buy Trityrosine?
You can request a quote for Trityrosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Trityrosine?
Yes, CoreyChem provides custom synthesis services for Trityrosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.