TL;DR: SS-228 Y (CAS 56257-16-0) is a chemical compound with molecular formula C19H14O6 and molecular weight 338.07904 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4a,8,12b-trihydroxy-4-methyl-1H-benzo[a]anthracene-2,7,12-trione
Also Known As: Antibiotic SS-228 Y, Antibiotic SS228Y, beta-228 Y, SS-228 Y, SS 228 Y
| Molecular Formula | C19H14O6 |
| Molecular Weight | 338.07904 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 338.07904 Da |
| Heavy Atoms | 25 |
| Complexity | 803.0 |
| SMILES | CC1=CC(=O)CC2(C1(C=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)O)O)O |
| InChIKey | SFKKPGUZOCFOBH-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SS-228 Y. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SS-228 Y. Following Lipinski's Rule of Five, SS-228 Y has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of SS-228 Y is 56257-16-0.
The molecular formula of SS-228 Y is C19H14O6.
The molecular weight of SS-228 Y is 338.07904 g/mol.
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