Isoscutellarein 6-galactoside
TL;DR: Isoscutellarein 6-galactoside (CAS 86668-63-5) is a chemical compound with molecular formula C21H20O11 and molecular weight 448.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7,8-trihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Also Known As: Isoscutellarein 6-galactoside, IS-Gal, 6-C-Galactopyranosylisoscutellarein, 6-C-galactopyranosyl-iso-scutellarein, 5,7,8-trihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
| Molecular Formula | C21H20O11 |
|---|---|
| Molecular Weight | 448.10 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 197.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.10056 |
| Heavy Atoms | 32 |
| Complexity | 721.0 |
Chemical Identifiers
| CAS Number | 86668-63-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C(=C3O2)O)O)[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O)O |
| InChIKey | RKEQWDAUYLDNEU-JVJUFRIASA-N |
Product Overview
Isoscutellarein 6-galactoside (CAS 86668-63-5), with molecular formula C21H20O11 and molecular weight 448.10 g/mol. IUPAC: 5,7,8-trihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one.
Chemical Property Profile of Isoscutellarein 6-galactoside
Property Insights of Isoscutellarein 6-galactoside
The XLogP value of -0.2 indicates that Isoscutellarein 6-galactoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 197.0 Ų indicates high polarity, suggesting Isoscutellarein 6-galactoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Isoscutellarein 6-galactoside has 8 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 Isoscutellarein 6-galactoside?
The CAS number of Isoscutellarein 6-galactoside is 86668-63-5.
What is the molecular formula of Isoscutellarein 6-galactoside?
The molecular formula of Isoscutellarein 6-galactoside is C21H20O11.
What is the molecular weight of Isoscutellarein 6-galactoside?
The molecular weight of Isoscutellarein 6-galactoside is 448.10 g/mol.
Where can I buy Isoscutellarein 6-galactoside?
You can request a quote for Isoscutellarein 6-galactoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoscutellarein 6-galactoside?
Yes, KEHONG BIO provides custom synthesis services for Isoscutellarein 6-galactoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.