TL;DR: 1-phospho-alpha-D-glucuronic acid (CAS 13168-11-1) is a chemical compound with molecular formula C6H11O10P and molecular weight 274.00897 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-phosphonooxyoxane-2-carboxylic acid
Also Known As: glucuronate-1-P, D-glucuronate-1-P, 1-phospho-alpha-D-glucuronic acid, D-Glucuronate 1-phosphate, 1-Phospho-alpha-D-glucuronate
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H11O10P |
| Molecular Weight | 274.00897 g/mol |
| XLogP | -3.4 |
| Topological Polar Surface Area (TPSA) | 174.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.00897 Da |
| Heavy Atoms | 17 |
| Complexity | 338.0 |
| SMILES | [C@@H]1([C@@H]([C@H](O[C@@H]([C@@H]1O)OP(=O)(O)O)C(=O)O)O)O |
| InChIKey | AIQDYKMWENWVQJ-QIUUJYRFSA-N |
The XLogP value of -3.4 indicates that 1-phospho-alpha-D-glucuronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting 1-phospho-alpha-D-glucuronic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-phospho-alpha-D-glucuronic acid has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1-phospho-alpha-D-glucuronic acid is 13168-11-1.
The molecular formula of 1-phospho-alpha-D-glucuronic acid is C6H11O10P.
The molecular weight of 1-phospho-alpha-D-glucuronic acid is 274.00897 g/mol.
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