Chrysin-7 beta-monoglucoside
TL;DR: Chrysin-7 beta-monoglucoside (CAS 31025-53-3) is a chemical compound with molecular formula C21H20O9 and molecular weight 416.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-hydroxy-2-phenyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Also Known As: Aequinetin, Equinoctin, Chrysin-7beta-monoglucoside, Chrysin 7-glucoside, chrysin-7-O-glucoside
| Molecular Formula | C21H20O9 |
|---|---|
| Molecular Weight | 416.11 g/mol |
| LogP | 0.3443 |
| Topological Polar Surface Area | 149.82 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 416.11072 |
| Heavy Atoms | 30 |
| Complexity | 1092.8225 |
Chemical Identifiers
| CAS Number | 31025-53-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O |
Product Overview
Chrysin-7 beta-monoglucoside (CAS 31025-53-3), with molecular formula C21H20O9 and molecular weight 416.11 g/mol. IUPAC: 5-hydroxy-2-phenyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.
Chemical Property Profile of Chrysin-7 beta-monoglucoside
Property Insights of Chrysin-7 beta-monoglucoside
The XLogP value of 0.3443 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chrysin-7 beta-monoglucoside. The TPSA of 149.82 Ų indicates high polarity, suggesting Chrysin-7 beta-monoglucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Chrysin-7 beta-monoglucoside has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chrysin-7 beta-monoglucoside?
The CAS number of Chrysin-7 beta-monoglucoside is 31025-53-3.
What is the molecular formula of Chrysin-7 beta-monoglucoside?
The molecular formula of Chrysin-7 beta-monoglucoside is C21H20O9.
What is the molecular weight of Chrysin-7 beta-monoglucoside?
The molecular weight of Chrysin-7 beta-monoglucoside is 416.11 g/mol.
Where can I buy Chrysin-7 beta-monoglucoside?
You can request a quote for Chrysin-7 beta-monoglucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chrysin-7 beta-monoglucoside?
Yes, KEHONG BIO provides custom synthesis services for Chrysin-7 beta-monoglucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.