Roseofungin
TL;DR: Roseofungin (CAS 12687-98-8) is a chemical compound with molecular formula C39H62O10 and molecular weight 690.4343 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
14,16,18,20,24,26-hexahydroxy-3-methyl-36-propan-2-yl-1-oxacyclohexatriaconta-3,5,7,9,11-pentaene-2,22,28-trione
Also Known As: Roseofungin, 14,16,18,20,24,26-Hexahydroxy-3-methyl-36-(1-methylethyl)oxacyclohexatriaconta-3,5,7,9,11,13-pentaene-2,22,28-trione
Technical Specifications
| Molecular Formula | C39H62O10 |
| Molecular Weight | 690.4343 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 182.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 1 |
| Exact Mass | 690.4343 Da |
| Heavy Atoms | 49 |
| Complexity | 1110.0 |
| SMILES | CC1=CC=CC=CC=CC=CCC(CC(CC(CC(CC(=O)CC(CC(CC(=O)CCCCCCCC(OC1=O)C(C)C)O)O)O)O)O)O |
| InChIKey | YHVUXVJMFMUNKX-UHFFFAOYSA-N |
Chemical Property Profile of Roseofungin
Property Insights of Roseofungin
The XLogP value of 5.4 indicates that Roseofungin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 182.0 Ų indicates high polarity, suggesting Roseofungin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Roseofungin has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Roseofungin?
The CAS number of Roseofungin is 12687-98-8.
What is the molecular formula of Roseofungin?
The molecular formula of Roseofungin is C39H62O10.
What is the molecular weight of Roseofungin?
The molecular weight of Roseofungin is 690.4343 g/mol.
Where can I buy Roseofungin?
You can request a quote for Roseofungin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Roseofungin?
Yes, CoreyChem provides custom synthesis services for Roseofungin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.