1-Peroxyferolide
TL;DR: 1-Peroxyferolide (CAS 61228-73-7) is a chemical compound with molecular formula C17H22O7 and molecular weight 338.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,4R,7R,10R,11R)-7-hydroperoxy-4-methyl-8,12-dimethylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradecan-10-yl] acetate
Also Known As: 1-Peroxyferolide, peroxyferolide, [(1S,2R,4R,7R,10R,11R)-7-hydroperoxy-4-methyl-8,12-dimethylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradecan-10-yl] acetate, ((1S,2R,4R,7R,10R,11R)-7-hydroperoxy-4-methyl-8,12-dimethylidene-13-oxo-3,14-dioxatricyclo(9.3.0.02,4)tetradecan-10-yl) acetate, (1aR,4R,7R,7aR,10aS,10bR)-4-Hydroperoxy-1a-methyl-5,8-dimethylidene-9-oxododecahydrooxireno[9,10]cyclodeca[1,2-b]furan-7-yl acetate
| Molecular Formula | C17H22O7 |
|---|---|
| Molecular Weight | 338.14 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 338.13657 |
| Heavy Atoms | 24 |
| Complexity | 598.0 |
Chemical Identifiers
| CAS Number | 61228-73-7 |
|---|---|
| SMILES | CC(=O)O[C@@H]1CC(=C)[C@@H](CC[C@@]2([C@H](O2)[C@@H]3[C@@H]1C(=C)C(=O)O3)C)OO |
| InChIKey | IHYLMNWQQGXGJT-TYVJZBCKSA-N |
Product Overview
1-Peroxyferolide (CAS 61228-73-7), with molecular formula C17H22O7 and molecular weight 338.14 g/mol. IUPAC: [(1S,2R,4R,7R,10R,11R)-7-hydroperoxy-4-methyl-8,12-dimethylidene-13-oxo-3,14-dioxatricyclo[9.3.0.02,4]tetradecan-10-yl] acetate.
Chemical Property Profile of 1-Peroxyferolide
Property Insights of 1-Peroxyferolide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Peroxyferolide. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Peroxyferolide. Following Lipinski's Rule of Five, 1-Peroxyferolide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Peroxyferolide?
The CAS number of 1-Peroxyferolide is 61228-73-7.
What is the molecular formula of 1-Peroxyferolide?
The molecular formula of 1-Peroxyferolide is C17H22O7.
What is the molecular weight of 1-Peroxyferolide?
The molecular weight of 1-Peroxyferolide is 338.14 g/mol.
Where can I buy 1-Peroxyferolide?
You can request a quote for 1-Peroxyferolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Peroxyferolide?
Yes, KEHONG BIO provides custom synthesis services for 1-Peroxyferolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.