Robustol
TL;DR: Robustol (CAS 27825-37-2) is a chemical compound with molecular formula C26H36O4 and molecular weight 412.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-oxatricyclo[20.2.2.13,7]heptacosa-1(24),3(27),4,6,22,25-hexaene-5,24,25-triol
Also Known As: robustol, 2-Oxatricyclo[20.2.2.1(3,7)]heptacosa-3,5,7(27),22,24,25-hexaene-5,24,25-triol, 2,5-[Oxy(5-hydroxy-1,3-phenylene)(tetradecane-1,14-diyl)]resorcinol, 2-oxatricyclo(20.2.2.13,7)heptacosa-1(24),3(27),4,6,22,25-hexaene-5,24,25-triol, 2-oxatricyclo[20.2.2.13,7]heptacosa-1(24),3(27),4,6,22,25-hexaene-5,24,25-triol
| Molecular Formula | C26H36O4 |
|---|---|
| Molecular Weight | 412.26 g/mol |
| LogP | 9.2 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 412.26135 |
| Heavy Atoms | 30 |
| Complexity | 444.0 |
Chemical Identifiers
| CAS Number | 27825-37-2 |
|---|---|
| SMILES | C1CCCCCCCC2=CC(=C(C(=C2)O)OC3=CC(=CC(=C3)O)CCCCCC1)O |
| InChIKey | ORJQIEGXRFXFHY-UHFFFAOYSA-N |
Product Overview
Robustol (CAS 27825-37-2), with molecular formula C26H36O4 and molecular weight 412.26 g/mol. IUPAC: 2-oxatricyclo[20.2.2.13,7]heptacosa-1(24),3(27),4,6,22,25-hexaene-5,24,25-triol.
Chemical Property Profile of Robustol
Property Insights of Robustol
The XLogP value of 9.2 indicates that Robustol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Robustol. Following Lipinski's Rule of Five, Robustol has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Robustol?
The CAS number of Robustol is 27825-37-2.
What is the molecular formula of Robustol?
The molecular formula of Robustol is C26H36O4.
What is the molecular weight of Robustol?
The molecular weight of Robustol is 412.26 g/mol.
Where can I buy Robustol?
You can request a quote for Robustol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Robustol?
Yes, KEHONG BIO provides custom synthesis services for Robustol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.