Epigallocatechin gallatyl glucoside
TL;DR: Epigallocatechin gallatyl glucoside (CAS 161802-03-5) is a chemical compound with molecular formula C28H28O16 and molecular weight 620.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R)-2-[3,5-dihydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
Also Known As: Inoveol egcg, Epigallocatechin gallatyl glucoside, (-)-Epigallocatechin gallate monoglucoside, Epigallocatechin gallatyl glucoside [INCI], J1.523.353B
| Molecular Formula | C28H28O16 |
|---|---|
| Molecular Weight | 620.14 g/mol |
| LogP | -0.2937 |
| Topological Polar Surface Area | 276.52 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 620.13776 |
| Heavy Atoms | 44 |
| Complexity | 1525.4226 |
Chemical Identifiers
| CAS Number | 161802-03-5 |
|---|---|
| SMILES | C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)OC(=O)C5=CC(=C(C(=C5)O)O)O |
Product Overview
Epigallocatechin gallatyl glucoside (CAS 161802-03-5), with molecular formula C28H28O16 and molecular weight 620.14 g/mol. IUPAC: [(2R,3R)-2-[3,5-dihydroxy-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate.
Chemical Property Profile of Epigallocatechin gallatyl glucoside
Property Insights of Epigallocatechin gallatyl glucoside
The XLogP value of -0.2937 indicates that Epigallocatechin gallatyl glucoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 276.52 Ų indicates high polarity, suggesting Epigallocatechin gallatyl glucoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Epigallocatechin gallatyl glucoside has 11 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Epigallocatechin gallatyl glucoside?
The CAS number of Epigallocatechin gallatyl glucoside is 161802-03-5.
What is the molecular formula of Epigallocatechin gallatyl glucoside?
The molecular formula of Epigallocatechin gallatyl glucoside is C28H28O16.
What is the molecular weight of Epigallocatechin gallatyl glucoside?
The molecular weight of Epigallocatechin gallatyl glucoside is 620.14 g/mol.
Where can I buy Epigallocatechin gallatyl glucoside?
You can request a quote for Epigallocatechin gallatyl glucoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epigallocatechin gallatyl glucoside?
Yes, KEHONG BIO provides custom synthesis services for Epigallocatechin gallatyl glucoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.