TL;DR: Versicolactone C (CAS 103963-36-6) is a chemical compound with molecular formula C15H22O4 and molecular weight 266.1518 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,4S,5S,8R,9S)-4,12-dihydroxy-5-methyl-8-prop-1-en-2-yl-10-oxatricyclo[7.2.1.01,5]dodecan-11-one
Also Known As: Versicolactone C, (1R,4S,5S,8R,9S)-4,12-dihydroxy-5-methyl-8-prop-1-en-2-yl-10-oxatricyclo[7.2.1.01,5]dodecan-11-one, (3S,4R,6aS,7S,9aR)-7,10-Dihydroxy-6a-methyl-4-(prop-1-en-2-yl)octahydro-1H-3,9a-methanocyclopenta[c]oxocin-1-one, 1H-3,9a-Methanocyclopent(c)oxocin-1-one, octahydro-7,10-dihydroxy-6a-methyl-4-(1-methylethenyl)-, (3S-(3alpha,4beta,6abeta,7beta,9aalpha,10R*))-, 7,10-Dihydroxy-6a-methyl-4-(prop-1-en-2-yl)octahydro-1H-3,9a-methanocyclopenta[c]oxocin-1-one
| Molecular Formula | C15H22O4 |
| Molecular Weight | 266.1518 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.1518 Da |
| Heavy Atoms | 19 |
| Complexity | 445.0 |
| SMILES | CC(=C)[C@H]1CC[C@@]2([C@H](CC[C@]23C([C@H]1OC3=O)O)O)C |
| InChIKey | ZWKJYFGQYZANRE-PDMNRUCYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Versicolactone C. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Versicolactone C. Following Lipinski's Rule of Five, Versicolactone C has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Versicolactone C is 103963-36-6.
The molecular formula of Versicolactone C is C15H22O4.
The molecular weight of Versicolactone C is 266.1518 g/mol.
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