Cytidylyl(5'.3')cytidylyl(5'.3')adenosine
TL;DR: Cytidylyl(5'.3')cytidylyl(5'.3')adenosine (CAS 3128-37-8) is a chemical compound with molecular formula C28H37N11O18P2 and molecular weight 877.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate
Also Known As: [3']cytidylic acid|EINECS 221-513-8|Cytidylyl(5'.3')cytidylyl(5'.3')adenosine|adenylyl(3'-5')cytidylyl(3'-5')cytidine|ADENYLYL(3-5)CYTIDYLYL(3-5)CYTIDINE FREE ACID|Cytidylyl-(5'=>3')-cytidylyl-(5'=>3')-adenosin|Cytidylyl(5'.fwdarw.3')cytidylyl(5'.fwdarw.3')adenosine|Adenylyl-(3a(2)a5a(2))-cytidylyl-(3a(2)a5a(2))-cytidine|3 -O-[3 -O-(5 -Cytidylyl)-5 -cytidylyl]adenosine|[(2R,3S,4R,5R)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-3-{[{[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl]oxy}-4-hydroxyoxolan-2-yl]methyl (2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl hydrogen phosphate|[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate|{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-2-{[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy})phosphinic acid
| Molecular Formula | C28H37N11O18P2 |
|---|---|
| Molecular Weight | 877.18 g/mol |
| LogP | -4.7808 |
| Topological Polar Surface Area | 431.8 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 14 |
| Exact Mass | 877.1793 |
| Heavy Atoms | 59 |
| Complexity | 2388.5706 |
Chemical Identifiers
| CAS Number | 3128-37-8 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O[C@@H]3[C@H](O[C@H]([C@@H]3O)N4C=CC(=NC4=O)N)COP(=O)(O)O[C@@H]5[C@H](O[C@H]([C@@H]5O)N6C=NC7=C(N=CN=C76)N)CO)O)O |
Product Overview
Cytidylyl(5'.3')cytidylyl(5'.3')adenosine (CAS 3128-37-8), with molecular formula C28H37N11O18P2 and molecular weight 877.18 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-4-hydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] hydrogen phosphate.
Chemical Property Profile of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine
Property Insights of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine
The XLogP value of -4.7808 indicates that Cytidylyl(5'.3')cytidylyl(5'.3')adenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 431.8 Ų indicates high polarity, suggesting Cytidylyl(5'.3')cytidylyl(5'.3')adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cytidylyl(5'.3')cytidylyl(5'.3')adenosine has 10 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine?
The CAS number of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine is 3128-37-8.
What is the molecular formula of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine?
The molecular formula of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine is C28H37N11O18P2.
What is the molecular weight of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine?
The molecular weight of Cytidylyl(5'.3')cytidylyl(5'.3')adenosine is 877.18 g/mol.
Where can I buy Cytidylyl(5'.3')cytidylyl(5'.3')adenosine?
You can request a quote for Cytidylyl(5'.3')cytidylyl(5'.3')adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cytidylyl(5'.3')cytidylyl(5'.3')adenosine?
Yes, KEHONG BIO provides custom synthesis services for Cytidylyl(5'.3')cytidylyl(5'.3')adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.