Purpurascenin
TL;DR: Purpurascenin (CAS 79105-52-5) is a chemical compound with molecular formula C23H26O10 and molecular weight 462.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5,6,7,8-pentamethoxy-2-(2,4,5-trimethoxyphenyl)chromen-4-one
Also Known As: PURPURASCENIN, 3,5,6,7,8,2',4',5'-Octamethoxyflavone, 2',3,4',5,5',6,7,8-Octamethoxyflavone, 3,5,6,7,8-pentamethoxy-2-(2,4,5-trimethoxyphenyl)chromen-4-one, 2 ,3,4 ,5,5 ,6,7,8-Octamethoxyflavone
| Molecular Formula | C23H26O10 |
|---|---|
| Molecular Weight | 462.15 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 462.1526 |
| Heavy Atoms | 33 |
| Complexity | 697.0 |
Chemical Identifiers
| CAS Number | 79105-52-5 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C2=C(C(=O)C3=C(O2)C(=C(C(=C3OC)OC)OC)OC)OC)OC)OC |
| InChIKey | DWKFMLSGCLXYER-UHFFFAOYSA-N |
Product Overview
Purpurascenin (CAS 79105-52-5), with molecular formula C23H26O10 and molecular weight 462.15 g/mol. IUPAC: 3,5,6,7,8-pentamethoxy-2-(2,4,5-trimethoxyphenyl)chromen-4-one.
Chemical Property Profile of Purpurascenin
Property Insights of Purpurascenin
The XLogP value of 3.2 indicates that Purpurascenin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Purpurascenin. Following Lipinski's Rule of Five, Purpurascenin has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Purpurascenin?
The CAS number of Purpurascenin is 79105-52-5.
What is the molecular formula of Purpurascenin?
The molecular formula of Purpurascenin is C23H26O10.
What is the molecular weight of Purpurascenin?
The molecular weight of Purpurascenin is 462.15 g/mol.
Where can I buy Purpurascenin?
You can request a quote for Purpurascenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Purpurascenin?
Yes, KEHONG BIO provides custom synthesis services for Purpurascenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.