6-Methoxyluteolin-7-O-glucuronic acid methyl ester
TL;DR: 6-Methoxyluteolin-7-O-glucuronic acid methyl ester (CAS 82657-11-2) is a chemical compound with molecular formula C23H22O13 and molecular weight 506.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
Also Known As: 6-Methoxyluteolin-7-O-glucuronic acid methyl ester, beta-D-Glucopyranosiduronic acid, 2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-7-yl, methyl ester, 2-(3,4-Dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-7-yl methyl beta-D-glucopyranosiduronate, 2-(3,4-Dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-7-yl methyl hexopyranosiduronate, methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
| Molecular Formula | C23H22O13 |
|---|---|
| Molecular Weight | 506.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 506.10605 |
| Heavy Atoms | 36 |
| Complexity | 848.0 |
Chemical Identifiers
| CAS Number | 82657-11-2 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC(=C(C=C3)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)OC)O)O)O |
| InChIKey | VSXQXYNBFPOEGX-VLXBDIDVSA-N |
Product Overview
6-Methoxyluteolin-7-O-glucuronic acid methyl ester (CAS 82657-11-2), with molecular formula C23H22O13 and molecular weight 506.11 g/mol. IUPAC: methyl (2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-6-methoxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate.
Chemical Property Profile of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester
Property Insights of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methoxyluteolin-7-O-glucuronic acid methyl ester. The TPSA of 202.0 Ų indicates high polarity, suggesting 6-Methoxyluteolin-7-O-glucuronic acid methyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Methoxyluteolin-7-O-glucuronic acid methyl ester 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 6-Methoxyluteolin-7-O-glucuronic acid methyl ester?
The CAS number of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester is 82657-11-2.
What is the molecular formula of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester?
The molecular formula of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester is C23H22O13.
What is the molecular weight of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester?
The molecular weight of 6-Methoxyluteolin-7-O-glucuronic acid methyl ester is 506.11 g/mol.
Where can I buy 6-Methoxyluteolin-7-O-glucuronic acid methyl ester?
You can request a quote for 6-Methoxyluteolin-7-O-glucuronic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methoxyluteolin-7-O-glucuronic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 6-Methoxyluteolin-7-O-glucuronic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.