Xanthofulvin
TL;DR: Xanthofulvin (CAS 151466-15-8) is a chemical compound with molecular formula C28H18O14 and molecular weight 578.06964 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetyl-7-[(Z)-(5-carboxy-6,7-dihydroxy-4-oxochromen-3-ylidene)-hydroxymethyl]-2,3-dihydroxy-6-methyl-9-oxoxanthene-1-carboxylic acid
Also Known As: Xanthofulvin, SM 216289, SPF 3059-1, J1.930.798K, 5-acetyl-7-[(Z)-(5-carboxy-6,7-dihydroxy-4-oxochromen-3-ylidene)-hydroxymethyl]-2,3-dihydroxy-6-methyl-9-oxoxanthene-1-carboxylic acid
Technical Specifications
| Molecular Formula | C28H18O14 |
| Molecular Weight | 578.06964 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 245.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 4 |
| Exact Mass | 578.06964 Da |
| Heavy Atoms | 42 |
| Complexity | 1210.0 |
| SMILES | CC1=C(C=C2C(=C1C(=O)C)OC3=C(C2=O)C(=C(C(=C3)O)O)C(=O)O)/C(=C/4\COC5=C(C4=O)C(=C(C(=C5)O)O)C(=O)O)/O |
| InChIKey | VZJACTNXARYXEM-NHDPSOOVSA-N |
Chemical Property Profile of Xanthofulvin
Property Insights of Xanthofulvin
The XLogP value of 3.1 indicates that Xanthofulvin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 245.0 Ų indicates high polarity, suggesting Xanthofulvin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Xanthofulvin has 7 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Xanthofulvin?
The CAS number of Xanthofulvin is 151466-15-8.
What is the molecular formula of Xanthofulvin?
The molecular formula of Xanthofulvin is C28H18O14.
What is the molecular weight of Xanthofulvin?
The molecular weight of Xanthofulvin is 578.06964 g/mol.
Where can I buy Xanthofulvin?
You can request a quote for Xanthofulvin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Xanthofulvin?
Yes, CoreyChem provides custom synthesis services for Xanthofulvin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.