Asperpyrone A
TL;DR: Asperpyrone A (CAS 491868-98-5) is a chemical compound with molecular formula C31H24O10 and molecular weight 556.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydroxy-9-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-10-methoxy-2-methylbenzo[h]chromen-8-one
Also Known As: Asperpyrone A, (aS)-asperpyrone A, J1.866.080F, 10-(5,8-dihydroxy-10-methoxy-2-methyl-4-oxo-4H-benzo[h]chromen-9-yl)-5-hydroxy-6,8-dimethoxy-2-methyl-4H-benzo[g]chromen-4-one, 10-(5,8-Dihydroxy-10-methoxy-2-methyl-4-oxo-4H-benzo[h]chromen-9-yl)-5-hydroxy-6,8-dimethoxy-2-methyl-benzo[g]chromen-4-one
| Molecular Formula | C31H24O10 |
|---|---|
| Molecular Weight | 556.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 141.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 556.13696 |
| Heavy Atoms | 41 |
| Complexity | 1440.0 |
Chemical Identifiers
| CAS Number | 491868-98-5 |
|---|---|
| SMILES | CC1=CC(=C2C(=CC3=CC(=O)C(=C(C3=C2O1)OC)C4=C5C(=C(C6=C4C=C(C=C6OC)OC)O)C(=O)C=C(O5)C)O)O |
| InChIKey | URHOXQWBGQQUMQ-UHFFFAOYSA-N |
Product Overview
Asperpyrone A (CAS 491868-98-5), with molecular formula C31H24O10 and molecular weight 556.14 g/mol. IUPAC: 4,5-dihydroxy-9-(5-hydroxy-6,8-dimethoxy-2-methyl-4-oxobenzo[g]chromen-10-yl)-10-methoxy-2-methylbenzo[h]chromen-8-one.
Chemical Property Profile of Asperpyrone A
Property Insights of Asperpyrone A
The XLogP value of 3.7 indicates that Asperpyrone A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 141.0 Ų indicates high polarity, suggesting Asperpyrone A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Asperpyrone A has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Asperpyrone A?
The CAS number of Asperpyrone A is 491868-98-5.
What is the molecular formula of Asperpyrone A?
The molecular formula of Asperpyrone A is C31H24O10.
What is the molecular weight of Asperpyrone A?
The molecular weight of Asperpyrone A is 556.14 g/mol.
Where can I buy Asperpyrone A?
You can request a quote for Asperpyrone A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Asperpyrone A?
Yes, KEHONG BIO provides custom synthesis services for Asperpyrone A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.