Cycloviracin B1
TL;DR: Cycloviracin B1 (CAS 142382-45-4) is a chemical compound with molecular formula C83H152O33 and molecular weight 1677.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[16,22-bis[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy]tricosyl]-14-[14-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy-20-hydroxyhenicosyl]-9,10,11,20,21,22-hexahydroxy-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.18,12]tetracosane-5,16-dione
Also Known As: Cycloviracin B1, Cycloviracin-B1, BU 4224V-B1, 3-[16,22-bis[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy]tricosyl]-14-[14-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy-20-hydroxyhenicosyl]-9,10,11,20,21,22-hexahydroxy-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.18,12]tetracosane-5,16-dione, 3-(16,22-Bis((2-O-methyl-beta-D-glucopyranosyl)oxy)tricosyl)-9,10,11,20,21,22-hexahydroxy-14-(20-hydroxy-14-((2-O-methyl-beta-D-glucopyranosyl)oxy)heneicosyl)-2,6,13,17,23,24-hexaoxatricyclo(17.3.1.1(8,12))tetracosane-5,16-dione
| Molecular Formula | C83H152O33 |
|---|---|
| Molecular Weight | 1677.02 g/mol |
| LogP | 8.2 |
| Topological Polar Surface Area | 496.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 33 |
| Rotatable Bonds | 54 |
| Exact Mass | 1677.0216 |
| Heavy Atoms | 116 |
| Complexity | 2520.0 |
Chemical Identifiers
| CAS Number | 142382-45-4 |
|---|---|
| SMILES | CC(CCCCCC(CCCCCCCCCCCCCC1CC(=O)OCC2C(C(C(C(O2)OC(CC(=O)OCC3C(C(C(C(O1)O3)O)O)O)CCCCCCCCCCCCCCCC(CCCCCC(C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)OC)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)OC)O)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)OC)O |
| InChIKey | UHXMKKIXCMBBAY-UKGVZLGJSA-N |
Product Overview
Cycloviracin B1 (CAS 142382-45-4), with molecular formula C83H152O33 and molecular weight 1677.02 g/mol. IUPAC: 3-[16,22-bis[[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy]tricosyl]-14-[14-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-methoxyoxan-2-yl]oxy-20-hydroxyhenicosyl]-9,10,11,20,21,22-hexahydroxy-2,6,13,17,23,24-hexaoxatricyclo[17.3.1.18,12]tetracosane-5,16-dione.
Chemical Property Profile of Cycloviracin B1
Property Insights of Cycloviracin B1
The XLogP value of 8.2 indicates that Cycloviracin B1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 496.0 Ų indicates high polarity, suggesting Cycloviracin B1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cycloviracin B1 has 16 hydrogen bond donor(s) and 33 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cycloviracin B1?
The CAS number of Cycloviracin B1 is 142382-45-4.
What is the molecular formula of Cycloviracin B1?
The molecular formula of Cycloviracin B1 is C83H152O33.
What is the molecular weight of Cycloviracin B1?
The molecular weight of Cycloviracin B1 is 1677.02 g/mol.
Where can I buy Cycloviracin B1?
You can request a quote for Cycloviracin B1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cycloviracin B1?
Yes, KEHONG BIO provides custom synthesis services for Cycloviracin B1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.