Iridin
TL;DR: Iridin (CAS 491-74-7) is a chemical compound with molecular formula C24H26O13 and molecular weight 522.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Iridin, Buddleoside, Irisin, Lridin, Irigenin 7-glucoside
| Molecular Formula | C24H26O13 |
|---|---|
| Molecular Weight | 522.14 g/mol |
| LogP | 0.0757 |
| Topological Polar Surface Area | 197.74 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 522.1373 |
| Heavy Atoms | 37 |
| Complexity | 1348.9482 |
Chemical Identifiers
| CAS Number | 491-74-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)O)C2=COC3=CC(=C(C(=C3C2=O)O)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
Product Overview
Iridin (CAS 491-74-7), with molecular formula C24H26O13 and molecular weight 522.14 g/mol. IUPAC: 5-hydroxy-3-(3-hydroxy-4,5-dimethoxyphenyl)-6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Iridin
Property Insights of Iridin
The XLogP value of 0.0757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iridin. The TPSA of 197.74 Ų indicates high polarity, suggesting Iridin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iridin has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Iridin?
The CAS number of Iridin is 491-74-7.
What is the molecular formula of Iridin?
The molecular formula of Iridin is C24H26O13.
What is the molecular weight of Iridin?
The molecular weight of Iridin is 522.14 g/mol.
Where can I buy Iridin?
You can request a quote for Iridin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Iridin?
Yes, KEHONG BIO provides custom synthesis services for Iridin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.