芝麻素酚
TL;DR: 芝麻素酚 (CAS 74061-79-3) is a chemical compound with molecular formula C20H18O7 and molecular weight 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芝麻素酚
6-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxol-5-ol
Also Known As: Sesaminol, (+)-sesaminol, Justisolin, Sesaminol, (+)-, 6-[(1s,3ar,4s,6ar)-4-(1,3-benzodioxol-5-yl)tetrahydro-1h,3h-furo[3,4-c]furan-1-yl]-1,3-benzodioxol-5-ol
| Molecular Formula | C20H18O7 |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 370.10526 |
| Heavy Atoms | 27 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 74061-79-3 |
|---|---|
| SMILES | C1[C@H]2[C@H](CO[C@@H]2C3=CC4=C(C=C3O)OCO4)[C@H](O1)C5=CC6=C(C=C5)OCO6 |
| InChIKey | KQRXQIPRDKVZPW-ISZNXKAUSA-N |
Product Overview
芝麻素酚 (CAS 74061-79-3), with molecular formula C20H18O7 and molecular weight 370.11 g/mol. IUPAC: 6-[(3S,3aR,6S,6aR)-3-(1,3-benzodioxol-5-yl)-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-6-yl]-1,3-benzodioxol-5-ol.
Chemical Property Profile of 芝麻素酚
Property Insights of 芝麻素酚
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 芝麻素酚. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 芝麻素酚. Following Lipinski's Rule of Five, 芝麻素酚 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 芝麻素酚?
The CAS number of 芝麻素酚 is 74061-79-3.
What is the molecular formula of 芝麻素酚?
The molecular formula of 芝麻素酚 is C20H18O7.
What is the molecular weight of 芝麻素酚?
The molecular weight of 芝麻素酚 is 370.11 g/mol.
Where can I buy 芝麻素酚?
You can request a quote for 芝麻素酚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芝麻素酚?
Yes, KEHONG BIO provides custom synthesis services for 芝麻素酚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.