Azalein
TL;DR: Azalein (CAS 29028-02-2) is a chemical compound with molecular formula C22H22O11 and molecular weight 462.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
Also Known As: Azalein, Azaleatin 3-rhamnoside, 2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one, Flavone, 3,3',4',7-tetrahydroxy-5-methoxy-, 3-rhamnoside, 3-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-3 ,4 ,7-trihydroxy-5-methoxyflavone
| Molecular Formula | C22H22O11 |
|---|---|
| Molecular Weight | 462.12 g/mol |
| LogP | 0.7917 |
| Topological Polar Surface Area | 179.28 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.1162 |
| Heavy Atoms | 33 |
| Complexity | 1251.3011 |
Chemical Identifiers
| CAS Number | 29028-02-2 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(OC3=C(C2=O)C(=CC(=C3)O)OC)C4=CC(=C(C=C4)O)O)O)O)O |
Product Overview
Azalein (CAS 29028-02-2), with molecular formula C22H22O11 and molecular weight 462.12 g/mol. IUPAC: 2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Azalein
Property Insights of Azalein
The XLogP value of 0.7917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Azalein. The TPSA of 179.28 Ų indicates high polarity, suggesting Azalein may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Azalein has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Azalein?
The CAS number of Azalein is 29028-02-2.
What is the molecular formula of Azalein?
The molecular formula of Azalein is C22H22O11.
What is the molecular weight of Azalein?
The molecular weight of Azalein is 462.12 g/mol.
Where can I buy Azalein?
You can request a quote for Azalein directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azalein?
Yes, KEHONG BIO provides custom synthesis services for Azalein and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.