7,8,9,9-Tetradehydroisolariciresinol
TL;DR: 7,8,9,9-Tetradehydroisolariciresinol (CAS 145918-59-8) is a chemical compound with molecular formula C20H20O6 and molecular weight 356.12598 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3R,4S)-6-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-3,4-dihydronaphthalene-2-carbaldehyde
Also Known As: 7,8,9,9-Tetradehydroisolariciresinol, Vitexin B-1, vitexin compound B-1, 7,8,9,9-Tetradehydroisolariciresil, HY-N2741
Technical Specifications
| Molecular Formula | C20H20O6 |
| Molecular Weight | 356.12598 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 96.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.12598 Da |
| Heavy Atoms | 26 |
| Complexity | 520.0 |
| SMILES | COC1=C(C=CC(=C1)[C@@H]2[C@H](C(=CC3=CC(=C(C=C23)O)OC)C=O)CO)O |
| InChIKey | PATMJUOZIPKVAS-YWZLYKJASA-N |
Chemical Property Profile of 7,8,9,9-Tetradehydroisolariciresinol
Property Insights of 7,8,9,9-Tetradehydroisolariciresinol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7,8,9,9-Tetradehydroisolariciresinol. The TPSA of 96.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 7,8,9,9-Tetradehydroisolariciresinol. Following Lipinski's Rule of Five, 7,8,9,9-Tetradehydroisolariciresinol has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 7,8,9,9-Tetradehydroisolariciresinol?
The CAS number of 7,8,9,9-Tetradehydroisolariciresinol is 145918-59-8.
What is the molecular formula of 7,8,9,9-Tetradehydroisolariciresinol?
The molecular formula of 7,8,9,9-Tetradehydroisolariciresinol is C20H20O6.
What is the molecular weight of 7,8,9,9-Tetradehydroisolariciresinol?
The molecular weight of 7,8,9,9-Tetradehydroisolariciresinol is 356.12598 g/mol.
Where can I buy 7,8,9,9-Tetradehydroisolariciresinol?
You can request a quote for 7,8,9,9-Tetradehydroisolariciresinol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 7,8,9,9-Tetradehydroisolariciresinol?
Yes, CoreyChem provides custom synthesis services for 7,8,9,9-Tetradehydroisolariciresinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.