TL;DR: (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid (CAS 136696-10-1) is a chemical compound with molecular formula C20H30O4 and molecular weight 334.21442 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5S)-5-hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid
Also Known As: 12-Oxo-ltb4, 12-Oxoleukotriene B4, 12-oxo Leukotriene B4, (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid, 6,8,10,14-Eicosatetraenoicacid, 5-hydroxy-12-oxo-, (5S,6Z,8E,10E,14Z)-
| Molecular Formula | C20H30O4 |
| Molecular Weight | 334.21442 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 334.21442 Da |
| Heavy Atoms | 24 |
| Complexity | 458.0 |
| SMILES | CCCCCC=CCC(=O)C=CC=CC=C[C@H](CCCC(=O)O)O |
| InChIKey | SJVWVCVZWMJXOK-LJQANCHMSA-N |
The XLogP value of 4.1 indicates that (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid. Following Lipinski's Rule of Five, (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid 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 (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid is 136696-10-1.
The molecular formula of (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid is C20H30O4.
The molecular weight of (5S)-5-Hydroxy-12-oxoicosa-6,8,10,14-tetraenoic acid is 334.21442 g/mol.
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