Epigallocatechin 3-O-(3,5-di-O-methylgallate)
TL;DR: Epigallocatechin 3-O-(3,5-di-O-methylgallate) (CAS 173484-92-9) is a chemical compound with molecular formula C24H22O11 and molecular weight 486.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 4-hydroxy-3,5-dimethoxybenzoate
Also Known As: Epigallocatechin 3-O-(3,5-di-O-methylgallate), Epigallocatechin 3-O-(3,5-dimethylgallate), (-)-Epigallocatechin 3-O-(3,5-O-dimethyl)gallate, Epigallocatechin 3-O-(3,5-di-O-methylgallic acid), [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 4-hydroxy-3,5-dimethoxybenzoate
| Molecular Formula | C24H22O11 |
|---|---|
| Molecular Weight | 486.12 g/mol |
| LogP | 2.8392 |
| Topological Polar Surface Area | 175.37 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.1162 |
| Heavy Atoms | 35 |
| Complexity | 1252.8584 |
Chemical Identifiers
| CAS Number | 173484-92-9 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C(=O)O[C@@H]2CC3=C(C=C(C=C3O[C@@H]2C4=CC(=C(C(=C4)O)O)O)O)O |
Product Overview
Epigallocatechin 3-O-(3,5-di-O-methylgallate) (CAS 173484-92-9), with molecular formula C24H22O11 and molecular weight 486.12 g/mol. IUPAC: [(2R,3R)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromen-3-yl] 4-hydroxy-3,5-dimethoxybenzoate.
Chemical Property Profile of Epigallocatechin 3-O-(3,5-di-O-methylgallate)
Property Insights of Epigallocatechin 3-O-(3,5-di-O-methylgallate)
The XLogP value of 2.8392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Epigallocatechin 3-O-(3,5-di-O-methylgallate). The TPSA of 175.37 Ų indicates high polarity, suggesting Epigallocatechin 3-O-(3,5-di-O-methylgallate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epigallocatechin 3-O-(3,5-di-O-methylgallate) 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 Epigallocatechin 3-O-(3,5-di-O-methylgallate)?
The CAS number of Epigallocatechin 3-O-(3,5-di-O-methylgallate) is 173484-92-9.
What is the molecular formula of Epigallocatechin 3-O-(3,5-di-O-methylgallate)?
The molecular formula of Epigallocatechin 3-O-(3,5-di-O-methylgallate) is C24H22O11.
What is the molecular weight of Epigallocatechin 3-O-(3,5-di-O-methylgallate)?
The molecular weight of Epigallocatechin 3-O-(3,5-di-O-methylgallate) is 486.12 g/mol.
Where can I buy Epigallocatechin 3-O-(3,5-di-O-methylgallate)?
You can request a quote for Epigallocatechin 3-O-(3,5-di-O-methylgallate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epigallocatechin 3-O-(3,5-di-O-methylgallate)?
Yes, KEHONG BIO provides custom synthesis services for Epigallocatechin 3-O-(3,5-di-O-methylgallate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.