9-deoxyanhydropodophyllol
TL;DR: 9-deoxyanhydropodophyllol (CAS 296-18-4) is a chemical compound with molecular formula C22H24O6 and molecular weight 384.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5R,5aR,8aR)-5-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydro-[2]benzofuro[5,6-f][1,3]benzodioxole
Also Known As: 9-deoxyanhydropodophyllol, KST-1A3544, J1.489.183H, 5,5a,6,8,8a,9-Hexahydro-5-(3,4,5-trimethoxyphenyl)furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxole stereoisomer, (5r,5ar,8ar)-5-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxole
| Molecular Formula | C22H24O6 |
|---|---|
| Molecular Weight | 384.16 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.1573 |
| Heavy Atoms | 28 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 296-18-4 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)[C@H]2[C@H]3COC[C@@H]3CC4=CC5=C(C=C24)OCO5 |
| InChIKey | CKUGPDQJERTFDI-WDUKFBBWSA-N |
Product Overview
9-deoxyanhydropodophyllol (CAS 296-18-4), with molecular formula C22H24O6 and molecular weight 384.16 g/mol. IUPAC: (5R,5aR,8aR)-5-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydro-[2]benzofuro[5,6-f][1,3]benzodioxole.
Chemical Property Profile of 9-deoxyanhydropodophyllol
Property Insights of 9-deoxyanhydropodophyllol
The XLogP value of 3.5 indicates that 9-deoxyanhydropodophyllol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 9-deoxyanhydropodophyllol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-deoxyanhydropodophyllol 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 9-deoxyanhydropodophyllol?
The CAS number of 9-deoxyanhydropodophyllol is 296-18-4.
What is the molecular formula of 9-deoxyanhydropodophyllol?
The molecular formula of 9-deoxyanhydropodophyllol is C22H24O6.
What is the molecular weight of 9-deoxyanhydropodophyllol?
The molecular weight of 9-deoxyanhydropodophyllol is 384.16 g/mol.
Where can I buy 9-deoxyanhydropodophyllol?
You can request a quote for 9-deoxyanhydropodophyllol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-deoxyanhydropodophyllol?
Yes, KEHONG BIO provides custom synthesis services for 9-deoxyanhydropodophyllol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.