Xanthomegnin
TL;DR: Xanthomegnin (CAS 1685-91-2) is a chemical compound with molecular formula C30H22O12 and molecular weight 574.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-hydroxy-8-(10-hydroxy-7-methoxy-3-methyl-1,6,9-trioxo-3,4-dihydrobenzo[g]isochromen-8-yl)-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromene-1,6,9-trione
Also Known As: Xanthomegnin, Xanthomegnine, 10-hydroxy-8-(10-hydroxy-7-methoxy-3-methyl-1,6,9-trioxo-3,4-dihydrobenzo[g]isochromen-8-yl)-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromene-1,6,9-trione, 3,3'-bis(2-methoxy-5-hydroxy-7-(2-hydroxypropyl)-8- carboxyl-1,4-naphthoquinone lactone), (3R)-10-hydroxy-8-[(3R)-10-hydroxy-7-methoxy-3-methyl-1,6,9-trioxo-3,4-dihydrobenzo[g]isochromen-8-yl]-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromene-1,6,9-trione
| Molecular Formula | C30H22O12 |
|---|---|
| Molecular Weight | 574.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 3 |
| Exact Mass | 574.11115 |
| Heavy Atoms | 42 |
| Complexity | 1260.0 |
Chemical Identifiers
| CAS Number | 1685-91-2 |
|---|---|
| SMILES | CC1CC2=CC3=C(C(=C2C(=O)O1)O)C(=O)C(=C(C3=O)OC)C4=C(C(=O)C5=C(C4=O)C(=C6C(=C5)CC(OC6=O)C)O)OC |
| InChIKey | WICHONPZVIYWIJ-UHFFFAOYSA-N |
Product Overview
Xanthomegnin (CAS 1685-91-2), with molecular formula C30H22O12 and molecular weight 574.11 g/mol. IUPAC: 10-hydroxy-8-(10-hydroxy-7-methoxy-3-methyl-1,6,9-trioxo-3,4-dihydrobenzo[g]isochromen-8-yl)-7-methoxy-3-methyl-3,4-dihydrobenzo[g]isochromene-1,6,9-trione.
Chemical Property Profile of Xanthomegnin
Property Insights of Xanthomegnin
The XLogP value of 4.0 indicates that Xanthomegnin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting Xanthomegnin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Xanthomegnin has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xanthomegnin?
The CAS number of Xanthomegnin is 1685-91-2.
What is the molecular formula of Xanthomegnin?
The molecular formula of Xanthomegnin is C30H22O12.
What is the molecular weight of Xanthomegnin?
The molecular weight of Xanthomegnin is 574.11 g/mol.
Where can I buy Xanthomegnin?
You can request a quote for Xanthomegnin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xanthomegnin?
Yes, KEHONG BIO provides custom synthesis services for Xanthomegnin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.