Myricetin hexaacetate
TL;DR: Myricetin hexaacetate (CAS 14813-29-7) is a chemical compound with molecular formula C27H22O14 and molecular weight 570.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,5-diacetyloxy-4-oxo-2-(3,4,5-triacetyloxyphenyl)chromen-7-yl] acetate
Also Known As: Myricetin hexaacetate, MYRICETINHEXAACETATE, 3,3',4',5,5',7-Hexahydroxyflavone hexaacetate, 5-18-05-00670 (Beilstein Handbook Reference), FLAVONE, 3,3',4',5,5',7-HEXAHYDROXY-, HEXAACETATE
| Molecular Formula | C27H22O14 |
|---|---|
| Molecular Weight | 570.10 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 184.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 13 |
| Exact Mass | 570.10095 |
| Heavy Atoms | 41 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 14813-29-7 |
|---|---|
| SMILES | CC(=O)OC1=CC2=C(C(=C1)OC(=O)C)C(=O)C(=C(O2)C3=CC(=C(C(=C3)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | QBFUXEWYAKYOPN-UHFFFAOYSA-N |
Product Overview
Myricetin hexaacetate (CAS 14813-29-7), with molecular formula C27H22O14 and molecular weight 570.10 g/mol. IUPAC: [3,5-diacetyloxy-4-oxo-2-(3,4,5-triacetyloxyphenyl)chromen-7-yl] acetate.
Chemical Property Profile of Myricetin hexaacetate
Property Insights of Myricetin hexaacetate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Myricetin hexaacetate. The TPSA of 184.0 Ų indicates high polarity, suggesting Myricetin hexaacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Myricetin hexaacetate has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Myricetin hexaacetate?
The CAS number of Myricetin hexaacetate is 14813-29-7.
What is the molecular formula of Myricetin hexaacetate?
The molecular formula of Myricetin hexaacetate is C27H22O14.
What is the molecular weight of Myricetin hexaacetate?
The molecular weight of Myricetin hexaacetate is 570.10 g/mol.
Where can I buy Myricetin hexaacetate?
You can request a quote for Myricetin hexaacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Myricetin hexaacetate?
Yes, KEHONG BIO provides custom synthesis services for Myricetin hexaacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.