Irigenol
TL;DR: Irigenol (CAS 4935-93-7) is a chemical compound with molecular formula C15H10O8 and molecular weight 318.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7-trihydroxy-3-(3,4,5-trihydroxyphenyl)chromen-4-one
Also Known As: IRIGENOL, Spectrum2_000801, Spectrum3_000207, Spectrum4_001603, Spectrum5_000325
| Molecular Formula | C15H10O8 |
|---|---|
| Molecular Weight | 318.04 g/mol |
| LogP | 1.6936 |
| Topological Polar Surface Area | 151.59 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.03757 |
| Heavy Atoms | 23 |
| Complexity | 979.5051 |
Chemical Identifiers
| CAS Number | 4935-93-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1O)O)O)C2=COC3=C(C2=O)C(=C(C(=C3)O)O)O |
Product Overview
Irigenol (CAS 4935-93-7), with molecular formula C15H10O8 and molecular weight 318.04 g/mol. IUPAC: 5,6,7-trihydroxy-3-(3,4,5-trihydroxyphenyl)chromen-4-one.
Chemical Property Profile of Irigenol
Property Insights of Irigenol
The XLogP value of 1.6936 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Irigenol. The TPSA of 151.59 Ų indicates high polarity, suggesting Irigenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Irigenol has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Irigenol?
The CAS number of Irigenol is 4935-93-7.
What is the molecular formula of Irigenol?
The molecular formula of Irigenol is C15H10O8.
What is the molecular weight of Irigenol?
The molecular weight of Irigenol is 318.04 g/mol.
Where can I buy Irigenol?
You can request a quote for Irigenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Irigenol?
Yes, KEHONG BIO provides custom synthesis services for Irigenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.