TL;DR: 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid (CAS 121979-37-1) is a chemical compound with molecular formula C20H32O4 and molecular weight 336.23007 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5E,8Z,10Z,12R,13R,14Z)-12,13-dihydroxyicosa-5,8,10,14-tetraenoic acid
Also Known As: 12,13-Dihete, 12,13-Deta, 12,13-Dihydroxyicosa-5,8,10,14-tetraenoic acid, 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid, 12,13-Dihydroxyeicosa-5,8,10,14-tetraenoic acid
| Molecular Formula | C20H32O4 |
| Molecular Weight | 336.23007 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 336.23007 Da |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
| SMILES | CCCCC/C=C\[C@H]([C@@H](/C=C\C=C/C/C=C/CCCC(=O)O)O)O |
| InChIKey | CGXPEDOFBFGHJH-PSFVRQRXSA-N |
The XLogP value of 4.1 indicates that 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid. Following Lipinski's Rule of Five, 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid has 3 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 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid is 121979-37-1.
The molecular formula of 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid is C20H32O4.
The molecular weight of 12,13-Dihydroxy-5,8,10,14-eicosatetraenoic acid is 336.23007 g/mol.
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