2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid
TL;DR: 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid (CAS 11045-18-4) is a chemical compound with molecular formula C15H23N5O14P2 and molecular weight 559.07166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]oxy-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: iso-ADP-ribose, phosphoribosyl-AMP, Ado(P)-Rib-P, PR-AMP, 2-(5''-Phosphoribosyl)-5'-amp
Technical Specifications
| Molecular Formula | C15H23N5O14P2 |
| Molecular Weight | 559.07166 g/mol |
| XLogP | -6.1 |
| Topological Polar Surface Area (TPSA) | 292.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 559.07166 Da |
| Heavy Atoms | 36 |
| Complexity | 864.0 |
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)(O)O)O)O)N |
| InChIKey | BHIWBSNWEZIHHL-ZQSHOCFMSA-N |
Chemical Property Profile of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid
Property Insights of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid
The XLogP value of -6.1 indicates that 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 292.0 Ų indicates high polarity, suggesting 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid has 8 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid?
The CAS number of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid is 11045-18-4.
What is the molecular formula of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid?
The molecular formula of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid is C15H23N5O14P2.
What is the molecular weight of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid?
The molecular weight of 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid is 559.07166 g/mol.
Where can I buy 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid?
You can request a quote for 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid?
Yes, CoreyChem provides custom synthesis services for 2'-O-(5-O-phosphono-beta-D-ribofuranosyl)-5'-adenylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.