14-O-Acetyl-talatisamine
TL;DR: 14-O-Acetyl-talatisamine (CAS 71239-55-9) is a chemical compound with molecular formula C26H41NO6 and molecular weight 463.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[11-ethyl-8-hydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] acetate
Also Known As: 14-O-Acetyl-talatisamine, 20-ethyl-8-hydroxy-1,16-dimethoxy-4-(methoxymethyl)aconitan-14-yl acetate, Aconitane-8,14-diol, 20-ethyl-1,16-dimethoxy-4-(methoxymethyl)-,14-acetate, (1alpha,14alpha,16beta)-
| Molecular Formula | C26H41NO6 |
|---|---|
| Molecular Weight | 463.29 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 77.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 463.2934 |
| Heavy Atoms | 33 |
| Complexity | 823.0 |
Chemical Identifiers
| CAS Number | 71239-55-9 |
|---|---|
| SMILES | CCN1CC2(CCC(C34C2CC(C31)C5(CC(C6CC4C5C6OC(=O)C)OC)O)OC)COC |
| InChIKey | ZHYCSYOPFIUANO-UHFFFAOYSA-N |
Product Overview
14-O-Acetyl-talatisamine (CAS 71239-55-9), with molecular formula C26H41NO6 and molecular weight 463.29 g/mol. IUPAC: [11-ethyl-8-hydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] acetate.
Chemical Property Profile of 14-O-Acetyl-talatisamine
Property Insights of 14-O-Acetyl-talatisamine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 14-O-Acetyl-talatisamine. The TPSA of 77.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 14-O-Acetyl-talatisamine. Following Lipinski's Rule of Five, 14-O-Acetyl-talatisamine 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 14-O-Acetyl-talatisamine?
The CAS number of 14-O-Acetyl-talatisamine is 71239-55-9.
What is the molecular formula of 14-O-Acetyl-talatisamine?
The molecular formula of 14-O-Acetyl-talatisamine is C26H41NO6.
What is the molecular weight of 14-O-Acetyl-talatisamine?
The molecular weight of 14-O-Acetyl-talatisamine is 463.29 g/mol.
Where can I buy 14-O-Acetyl-talatisamine?
You can request a quote for 14-O-Acetyl-talatisamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 14-O-Acetyl-talatisamine?
Yes, KEHONG BIO provides custom synthesis services for 14-O-Acetyl-talatisamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.