1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone
TL;DR: 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone (CAS 75252-35-6) is a chemical compound with molecular formula C30H41N3O15P2 and molecular weight 745.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen phosphate
Also Known As: Ara-cdp-prednisolone, 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone, P1-(Prednisolone-21-yl)-P2-(1-beta-D-arabinofuranosylcytosine-5'-yl)pyrophosphate, [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen phosphate, 2(1H)-Pyrimidinone, 4-amino-1-(5-O-((((((11beta)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl)oxy)hydroxyphosphinyl)oxy)hydroxyphosphinyl)-beta-D-arabinofuranosyl)-
| Molecular Formula | C30H41N3O15P2 |
|---|---|
| Molecular Weight | 745.20 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 285.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 745.2013 |
| Heavy Atoms | 50 |
| Complexity | 1680.0 |
Chemical Identifiers
| CAS Number | 75252-35-6 |
|---|---|
| SMILES | C[C@]12C[C@@H](C3C(C1CC[C@@]2(C(=O)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@@H]([C@@H](O4)N5C=CC(=NC5=O)N)O)O)O)CCC6=CC(=O)C=C[C@]36C)O |
| InChIKey | BHVHEUQEPAHXLE-DXCUYQCOSA-N |
Product Overview
1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone (CAS 75252-35-6), with molecular formula C30H41N3O15P2 and molecular weight 745.20 g/mol. IUPAC: [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [2-[(10R,11S,13S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] hydrogen phosphate.
Chemical Property Profile of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone
Property Insights of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone
The XLogP value of -2.7 indicates that 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 285.0 Ų indicates high polarity, suggesting 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone?
The CAS number of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone is 75252-35-6.
What is the molecular formula of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone?
The molecular formula of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone is C30H41N3O15P2.
What is the molecular weight of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone?
The molecular weight of 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone is 745.20 g/mol.
Where can I buy 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone?
You can request a quote for 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone?
Yes, KEHONG BIO provides custom synthesis services for 1(beta)-D-Arabinofuranosylcytosine-5'-diphosphate prednisolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.