TL;DR: Olomoucin (CAS 87414-49-1) is a chemical compound with molecular formula C24H24O7 and molecular weight 424.1522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate
Also Known As: butyrolactone i, olomoucin, [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxofuran-2-carboxylate, methyl 4-hydroxy-2-[[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl]-3-(4-hydroxyphenyl)-5-oxofuran-2-carboxylate, [4-hydroxy-3-(3-methylbut-2-enyl)phenyl]methyl (2R)-4-hydroxy-3-(4-hydroxyphenyl)-2-methyl-5-oxo-furan-2-carboxylate
| Molecular Formula | C24H24O7 |
| Molecular Weight | 424.1522 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.1522 Da |
| Heavy Atoms | 31 |
| Complexity | 743.0 |
| SMILES | CC(=CCC1=C(C=CC(=C1)COC(=O)[C@]2(C(=C(C(=O)O2)O)C3=CC=C(C=C3)O)C)O)C |
| InChIKey | FPVUCBMBMUHRDX-XMMPIXPASA-N |
The XLogP value of 4.3 indicates that Olomoucin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Olomoucin. Following Lipinski's Rule of Five, Olomoucin has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Olomoucin is 87414-49-1.
The molecular formula of Olomoucin is C24H24O7.
The molecular weight of Olomoucin is 424.1522 g/mol.
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