Ribocitrin sodium salt
TL;DR: Ribocitrin sodium salt (CAS 78798-55-7) is a chemical compound with molecular formula C22H31Na3O19 and molecular weight 668.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trisodium;2-[(2R,3R,4R,5R)-3,4-bis[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy]-5-(hydroxymethyl)oxolan-2-yl]oxybutane-1,2,4-tricarboxylate
Also Known As: Ribocitrin sodium salt, 1,2,4-Butanetricarboxylic acid, 2-((O-alpha-D-ribofuranosyl-(1-2)-O-alpha-D-ribofuranosyl-(1-3)-alpha-D-ribofuranosyl)oxy)-, (S)-, trisodium salt, hydrate, trisodium 2-[(2R,3R,4R,5R)-3,4-bis[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy]-5-(hydroxymethyl)oxolan-2-yl]oxybutane-1,2,4-tricarboxylate, Trisodium 2-{[alpha-D-ribofuranosyl-(1->2)-[alpha-D-ribofuranosyl-(1->3)]-alpha-D-ribofuranosyl]oxy}butane-1,2,4-tricarboxylate, Trisodium 2-{[pentofuranosyl-(1->2)-[pentofuranosyl-(1->3)]pentofuranosyl]oxy}butane-1,2,4-tricarboxylate
| Molecular Formula | C22H31Na3O19 |
|---|---|
| Molecular Weight | 668.12 g/mol |
| LogP | -18.4606 |
| Topological Polar Surface Area | 317.38 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 15 |
| Exact Mass | 668.11523 |
| Heavy Atoms | 44 |
| Complexity | 933.1112 |
Chemical Identifiers
| CAS Number | 78798-55-7 |
|---|---|
| SMILES | C(CC(CC(=O)[O-])(C(=O)[O-])O[C@@H]1[C@@H]([C@@H]([C@H](O1)CO)O[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)O[C@@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)C(=O)[O-].[Na+].[Na+].[Na+] |
Product Overview
Ribocitrin sodium salt (CAS 78798-55-7), with molecular formula C22H31Na3O19 and molecular weight 668.12 g/mol. IUPAC: trisodium;2-[(2R,3R,4R,5R)-3,4-bis[[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy]-5-(hydroxymethyl)oxolan-2-yl]oxybutane-1,2,4-tricarboxylate.
Chemical Property Profile of Ribocitrin sodium salt
Property Insights of Ribocitrin sodium salt
The XLogP value of -18.4606 indicates that Ribocitrin sodium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 317.38 Ų indicates high polarity, suggesting Ribocitrin sodium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ribocitrin sodium salt has 7 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ribocitrin sodium salt?
The CAS number of Ribocitrin sodium salt is 78798-55-7.
What is the molecular formula of Ribocitrin sodium salt?
The molecular formula of Ribocitrin sodium salt is C22H31Na3O19.
What is the molecular weight of Ribocitrin sodium salt?
The molecular weight of Ribocitrin sodium salt is 668.12 g/mol.
Where can I buy Ribocitrin sodium salt?
You can request a quote for Ribocitrin sodium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ribocitrin sodium salt?
Yes, KEHONG BIO provides custom synthesis services for Ribocitrin sodium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.