TL;DR: Phoslactomycin A (CAS 159991-67-0) is a chemical compound with molecular formula C29H46NO10P and molecular weight 599.28595 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-[(1E,3E,9E)-8-(2-aminoethyl)-10-(3-ethyl-6-oxo-2,3-dihydropyran-2-yl)-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 2-methylpropanoate
Also Known As: Phoslactomycin A, [3-[(1E,3E,9E)-8-(2-aminoethyl)-10-(3-ethyl-6-oxo-2,3-dihydropyran-2-yl)-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl]cyclohexyl] 2-methylpropanoate, (3-((1E,3E,9E)-8-(2-aminoethyl)-10-(3-ethyl-6-oxo-2,3-dihydropyran-2-yl)-5,8-dihydroxy-7-phosphonooxydeca-1,3,9-trienyl)cyclohexyl) 2-methylpropanoate, {[(1E,7E,9E)a3a(2aAminoethyl)a1a(3aethyla6aoxoa3,6adihydroa2Hapyrana2ayl)a3,6adihydroxya10a{3a[(2amethylpropanoyl)oxy]cyclohexyl}decaa1,7,9atriena4ayl]oxy}phosphonic acid, {[3-(2-aminoethyl)-1-(3-ethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)-3,6-dihydroxy-10-{3-[(2-methylpropanoyl)oxy]cyclohexyl}deca-1,7,9-trien-4-yl]oxy}phosphonic acid
| Molecular Formula | C29H46NO10P |
| Molecular Weight | 599.28595 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 186.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 16 |
| Exact Mass | 599.28595 Da |
| Heavy Atoms | 41 |
| Complexity | 1020.0 |
| SMILES | CCC1C=CC(=O)OC1/C=C/C(CCN)(C(CC(/C=C/C=C/C2CCCC(C2)OC(=O)C(C)C)O)OP(=O)(O)O)O |
| InChIKey | LOAKADZNOAGFPM-XNHNZVDCSA-N |
The XLogP value of -0.4 indicates that Phoslactomycin A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 186.0 Ų indicates high polarity, suggesting Phoslactomycin A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Phoslactomycin A has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Phoslactomycin A is 159991-67-0.
The molecular formula of Phoslactomycin A is C29H46NO10P.
The molecular weight of Phoslactomycin A is 599.28595 g/mol.
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