5'-Phosphatidylcytidine
TL;DR: 5'-Phosphatidylcytidine (CAS 119459-68-6) is a chemical compound with molecular formula C44H80N3O12P and molecular weight 873.55 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate
Also Known As: 5'-Phosphatidylcytidine, 5/'-Phosphatidylcytidine, [(2R)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate, 5'-o-[{[(2r)-2,3-bis(hexadecanoyloxy)propyl]oxy}(hydroxy)phosphoryl]cytidine, 1-(5-O-{[(2R)-2,3-Bis(hexadecanoyloxy)propoxy](hydroxy)phosphoryl}-beta-D-ribofuranosyl)-4-imino-1,4-dihydropyrimidin-2-ol
| Molecular Formula | C44H80N3O12P |
|---|---|
| Molecular Weight | 873.55 g/mol |
| LogP | 11.6 |
| Topological Polar Surface Area | 217.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 40 |
| Exact Mass | 873.548 |
| Heavy Atoms | 60 |
| Complexity | 1290.0 |
Chemical Identifiers
| CAS Number | 119459-68-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O)OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | FSGOTRMUMPHHJV-BQUKFSKHSA-N |
Product Overview
5'-Phosphatidylcytidine (CAS 119459-68-6), with molecular formula C44H80N3O12P and molecular weight 873.55 g/mol. IUPAC: [(2R)-3-[[(2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate.
Chemical Property Profile of 5'-Phosphatidylcytidine
Property Insights of 5'-Phosphatidylcytidine
The XLogP value of 11.6 indicates that 5'-Phosphatidylcytidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 217.0 Ų indicates high polarity, suggesting 5'-Phosphatidylcytidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-Phosphatidylcytidine has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'-Phosphatidylcytidine?
The CAS number of 5'-Phosphatidylcytidine is 119459-68-6.
What is the molecular formula of 5'-Phosphatidylcytidine?
The molecular formula of 5'-Phosphatidylcytidine is C44H80N3O12P.
What is the molecular weight of 5'-Phosphatidylcytidine?
The molecular weight of 5'-Phosphatidylcytidine is 873.55 g/mol.
Where can I buy 5'-Phosphatidylcytidine?
You can request a quote for 5'-Phosphatidylcytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Phosphatidylcytidine?
Yes, KEHONG BIO provides custom synthesis services for 5'-Phosphatidylcytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.