Robustaol A
TL;DR: Robustaol A (CAS 78411-76-4) is a chemical compound with molecular formula C25H30O9 and molecular weight 474.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2,6-dihydroxy-4-methoxy-3-methyl-5-(2-methylpropanoyl)phenyl]methyl]-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde
Also Known As: Robustaol A, Robustaol, J2.771.411K, 3-[[2,6-dihydroxy-4-methoxy-3-methyl-5-(2-methylpropanoyl)phenyl]methyl]-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde, 3-{[2,6-dihydroxy-4-methoxy-3-methyl-5-(2-methylpropanoyl)phenyl]methyl}-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde
| Molecular Formula | C25H30O9 |
|---|---|
| Molecular Weight | 474.19 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 162.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 474.189 |
| Heavy Atoms | 34 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 78411-76-4 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1OC)C(=O)C(C)C)O)CC2=C(C(=C(C(=C2O)C(=O)CC(C)C)O)C=O)O)O |
| InChIKey | VQIUVVRPDIFIPV-UHFFFAOYSA-N |
Product Overview
Robustaol A (CAS 78411-76-4), with molecular formula C25H30O9 and molecular weight 474.19 g/mol. IUPAC: 3-[[2,6-dihydroxy-4-methoxy-3-methyl-5-(2-methylpropanoyl)phenyl]methyl]-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde.
Chemical Property Profile of Robustaol A
Property Insights of Robustaol A
The XLogP value of 5.2 indicates that Robustaol A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.0 Ų indicates high polarity, suggesting Robustaol A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Robustaol A has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Robustaol A?
The CAS number of Robustaol A is 78411-76-4.
What is the molecular formula of Robustaol A?
The molecular formula of Robustaol A is C25H30O9.
What is the molecular weight of Robustaol A?
The molecular weight of Robustaol A is 474.19 g/mol.
Where can I buy Robustaol A?
You can request a quote for Robustaol A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Robustaol A?
Yes, KEHONG BIO provides custom synthesis services for Robustaol A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.