AK toxin II
TL;DR: AK toxin II (CAS 85146-10-7) is a chemical compound with molecular formula C22H25NO6 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E,4Z,6E,8R)-8-[(2S)-2-acetamido-3-phenylpropanoyl]oxy-8-[(2S)-2-methyloxiran-2-yl]octa-2,4,6-trienoic acid
Also Known As: AK toxin II, (2E,4Z,6E,8R)-8-[(2S)-2-acetamido-3-phenylpropanoyl]oxy-8-[(2S)-2-methyloxiran-2-yl]octa-2,4,6-trienoic acid, (R,2E,4Z,6E)-8-((acetyl-L-phenylalanyl)oxy)-8-((S)-2-methyloxiran-2-yl)octa-2,4,6-trienoic acid, L-Phenylalanine, N-acetyl-, 7-carboxy-1-(2-methyloxiranyl)-2,4,6-heptatrienyl ester, (2S-(2R*(1S*,2E,4Z,6E)))-, (2E,4Z,6E,8R)-8-[[(2S)-2-(Acetylamino)-3-phenylpropanoyl]oxy]-8-[(2S)-2-methyloxirane-2-yl]-2,4,6-octatrienoic acid
| Molecular Formula | C22H25NO6 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | 2.1877 |
| Topological Polar Surface Area | 105.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 399.16818 |
| Heavy Atoms | 29 |
| Complexity | 807.8512 |
Chemical Identifiers
| CAS Number | 85146-10-7 |
|---|---|
| SMILES | CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O[C@H](/C=C/C=C\C=C\C(=O)O)[C@@]2(CO2)C |
Product Overview
AK toxin II (CAS 85146-10-7), with molecular formula C22H25NO6 and molecular weight 399.17 g/mol. IUPAC: (2E,4Z,6E,8R)-8-[(2S)-2-acetamido-3-phenylpropanoyl]oxy-8-[(2S)-2-methyloxiran-2-yl]octa-2,4,6-trienoic acid.
Chemical Property Profile of AK toxin II
Property Insights of AK toxin II
The XLogP value of 2.1877 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AK toxin II. The TPSA of 105.23 Ų falls within the moderate polarity range, balancing permeability and solubility for AK toxin II. Following Lipinski's Rule of Five, AK toxin II has 2 hydrogen bond donor(s) and 5 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 AK toxin II?
The CAS number of AK toxin II is 85146-10-7.
What is the molecular formula of AK toxin II?
The molecular formula of AK toxin II is C22H25NO6.
What is the molecular weight of AK toxin II?
The molecular weight of AK toxin II is 399.17 g/mol.
Where can I buy AK toxin II?
You can request a quote for AK toxin II directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AK toxin II?
Yes, KEHONG BIO provides custom synthesis services for AK toxin II and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.