松脂酚
TL;DR: 松脂酚 (CAS 487-36-5) is a chemical compound with molecular formula C20H22O6 and molecular weight 358.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
松脂酚
4-[(3S,3aR,6S,6aR)-6-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol
Also Known As: Pinoresinol, (+)-Pinoresinol, pino-resinol, D-PINORESINOL, Pinoresinol (Standard)
| Molecular Formula | C20H22O6 |
|---|---|
| Molecular Weight | 358.14 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.14163 |
| Heavy Atoms | 26 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 487-36-5 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)[C@@H]2[C@H]3CO[C@@H]([C@H]3CO2)C4=CC(=C(C=C4)O)OC)O |
| InChIKey | HGXBRUKMWQGOIE-AFHBHXEDSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
松脂酚 (CAS 487-36-5), with molecular formula C20H22O6 and molecular weight 358.14 g/mol. IUPAC: 4-[(3S,3aR,6S,6aR)-6-(4-hydroxy-3-methoxyphenyl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenol.
Chemical Property Profile of 松脂酚
Property Insights of 松脂酚
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 松脂酚. The TPSA of 77.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 松脂酚. Following Lipinski's Rule of Five, 松脂酚 has 2 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 松脂酚?
The CAS number of 松脂酚 is 487-36-5.
What is the molecular formula of 松脂酚?
The molecular formula of 松脂酚 is C20H22O6.
What is the molecular weight of 松脂酚?
The molecular weight of 松脂酚 is 358.14 g/mol.
Where can I buy 松脂酚?
You can request a quote for 松脂酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 松脂酚?
Yes, KEHONG BIO provides custom synthesis services for 松脂酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.