TL;DR: Peroxisomicine a1 (CAS 56678-11-6) is a chemical compound with molecular formula C30H26O8 and molecular weight 514.1628 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,8,9-trihydroxy-3-methyl-7-(2,5,10-trihydroxy-2-methyl-4-oxo-1,3-dihydroanthracen-9-yl)-2,4-dihydroanthracen-1-one
Also Known As: Peroxisomicine a1, PeroxisomicineA1, Karwinskia toxin T-514, Toxin T 514, toxin 514, Karwinskia
| Molecular Formula | C30H26O8 |
| Molecular Weight | 514.1628 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 156.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 514.1628 Da |
| Heavy Atoms | 38 |
| Complexity | 970.0 |
| SMILES | CC1(CC2=C(C(=O)C1)C(=C3C(=C2)C=CC(=C3O)C4=C5CC(CC(=O)C5=C(C6=C4C=CC=C6O)O)(C)O)O)O |
| InChIKey | FBPZAGOTWAVQJH-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that Peroxisomicine a1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.0 Ų indicates high polarity, suggesting Peroxisomicine a1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Peroxisomicine a1 has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Peroxisomicine a1 is 56678-11-6.
The molecular formula of Peroxisomicine a1 is C30H26O8.
The molecular weight of Peroxisomicine a1 is 514.1628 g/mol.
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