TL;DR: PS(16:0/0:0) (CAS 116947-34-3) is a chemical compound with molecular formula C22H44NO9P and molecular weight 497.27536 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-2-amino-3-[[(2R)-3-hexadecanoyloxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxypropanoic acid
Also Known As: Palmitoyllysophosphatidylserine, LysoPS(16:0/0:0), LPS(16:0), 1-hexadecanoyl-sn-glycero-3-phosphoserine, PS(16:0/0:0)
| Molecular Formula | C22H44NO9P |
| Molecular Weight | 497.27536 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 166.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 24 |
| Exact Mass | 497.27536 Da |
| Heavy Atoms | 33 |
| Complexity | 562.0 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](C(=O)O)N)O |
| InChIKey | XIVOBOJQPNEUSC-UXHICEINSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for PS(16:0/0:0). The TPSA of 166.0 Ų indicates high polarity, suggesting PS(16:0/0:0) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, PS(16:0/0:0) has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of PS(16:0/0:0) is 116947-34-3.
The molecular formula of PS(16:0/0:0) is C22H44NO9P.
The molecular weight of PS(16:0/0:0) is 497.27536 g/mol.
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