芦藤酮
TL;DR: 芦藤酮 (CAS 83-79-4) is a chemical compound with molecular formula C23H22O6 and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芦藤酮
16,17-dimethoxy-6-prop-1-en-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
Also Known As: rotenone, Tubatoxin, Barbasco, Rotocide, Extrax
| Molecular Formula | C23H22O6 |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 394.14163 |
| Heavy Atoms | 29 |
| Complexity | 664.0 |
Chemical Identifiers
| CAS Number | 83-79-4 |
|---|---|
| SMILES | CC(=C)C1CC2=C(O1)C=CC3=C2OC4COC5=CC(=C(C=C5C4C3=O)OC)OC |
| InChIKey | JUVIOZPCNVVQFO-UHFFFAOYSA-N |
Product Overview
芦藤酮 (CAS 83-79-4), with molecular formula C23H22O6 and molecular weight 394.14 g/mol. IUPAC: 16,17-dimethoxy-6-prop-1-en-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one.
Chemical Property Profile of 芦藤酮
Property Insights of 芦藤酮
The XLogP value of 4.1 indicates that 芦藤酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 芦藤酮. Following Lipinski's Rule of Five, 芦藤酮 has 0 hydrogen bond donor(s) and 6 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 芦藤酮?
The CAS number of 芦藤酮 is 83-79-4.
What is the molecular formula of 芦藤酮?
The molecular formula of 芦藤酮 is C23H22O6.
What is the molecular weight of 芦藤酮?
The molecular weight of 芦藤酮 is 394.14 g/mol.
Where can I buy 芦藤酮?
You can request a quote for 芦藤酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芦藤酮?
Yes, KEHONG BIO provides custom synthesis services for 芦藤酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.