AF toxin III
TL;DR: AF toxin III (CAS 108102-62-1) is a chemical compound with molecular formula C22H32O8 and molecular weight 424.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4E,6E)-8-[2-(2-hydroxy-3-methylbutanoyl)oxy-3-methylpentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid
Also Known As: AF toxin III, (2E,4E,6E)-8-[2-(2-hydroxy-3-methylbutanoyl)oxy-3-methylpentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid, 2,4,6-Octatrienoic acid, 8-((2-(2,3-dihydroxy-3-methyl-1-oxobutoxy)-3-methyl-1-oxopentyl)oxy)-8-(2-methyloxiranyl)-
| Molecular Formula | C22H32O8 |
|---|---|
| Molecular Weight | 424.21 g/mol |
| LogP | 2.4151 |
| Topological Polar Surface Area | 122.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 424.20972 |
| Heavy Atoms | 30 |
| Complexity | 687.2511 |
Chemical Identifiers
| CAS Number | 108102-62-1 |
|---|---|
| SMILES | CCC(C)C(C(=O)OC(/C=C/C=C/C=C/C(=O)O)C1(CO1)C)OC(=O)C(C(C)C)O |
Product Overview
AF toxin III (CAS 108102-62-1), with molecular formula C22H32O8 and molecular weight 424.21 g/mol. IUPAC: (2E,4E,6E)-8-[2-(2-hydroxy-3-methylbutanoyl)oxy-3-methylpentanoyl]oxy-8-(2-methyloxiran-2-yl)octa-2,4,6-trienoic acid.
Chemical Property Profile of AF toxin III
Property Insights of AF toxin III
The XLogP value of 2.4151 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AF toxin III. The TPSA of 122.66 Ų falls within the moderate polarity range, balancing permeability and solubility for AF toxin III. Following Lipinski's Rule of Five, AF toxin III has 2 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 AF toxin III?
The CAS number of AF toxin III is 108102-62-1.
What is the molecular formula of AF toxin III?
The molecular formula of AF toxin III is C22H32O8.
What is the molecular weight of AF toxin III?
The molecular weight of AF toxin III is 424.21 g/mol.
Where can I buy AF toxin III?
You can request a quote for AF toxin III directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF toxin III?
Yes, KEHONG BIO provides custom synthesis services for AF toxin III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.