2.0 2012-07-30 14:54:40 -0600 2015-06-03 17:20:42 -0600 ECMDB21129 M2MDB001538 1-hexadecanoyl-sn-glycerol 3-phosphate 1-hexadecanoyl-sn-glycerol 3-phosphate belongs to the class of Lysophosphatidic Acids. These are glycerophosphates where the glycerol is esterified with one saturated fatty acid. (inferred from compound structure) (2-hydroxy-3-phosphonooxypropyl) hexadecanoate (2-Hydroxy-3-phosphonooxypropyl) hexadecanoic acid 1-Hexadecanoyl-sn-glycero-3-phosphate 1-Hexadecanoyl-sn-glycero-3-phosphoric acid 1-Hexadecanoyl-sn-glycerol 3-phosphoric acid 1-Palmitoyl lysophosphatidate 1-Palmitoyl lysophosphatidic acid 1-Palmitoylglycerol 3-phosphate 1-Palmitoylglycerol 3-phosphoric acid C19H39O7P 410.4825 410.243340114 [3-(hexadecanoyloxy)-2-hydroxypropoxy]phosphonic acid PLPA CCCCCCCCCCCCCCCC(=O)OCC(O)COP(O)(O)=O InChI=1S/C19H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(21)25-16-18(20)17-26-27(22,23)24/h18,20H,2-17H2,1H3,(H2,22,23,24) YNDYKPRNFWPPFU-UHFFFAOYSA-N Membrane logp 3.87 ALOGPS logs -5.23 ALOGPS solubility 2.42e-03 g/l ALOGPS logp 4.96 ChemAxon pka_strongest_acidic 1.51 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac [3-(hexadecanoyloxy)-2-hydroxypropoxy]phosphonic acid ChemAxon average_mass 410.4825 ChemAxon mono_mass 410.243340114 ChemAxon smiles CCCCCCCCCCCCCCCC(=O)OCC(O)COP(O)(O)=O ChemAxon formula C19H39O7P ChemAxon inchi InChI=1S/C19H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(21)25-16-18(20)17-26-27(22,23)24/h18,20H,2-17H2,1H3,(H2,22,23,24) ChemAxon inchikey YNDYKPRNFWPPFU-UHFFFAOYSA-N ChemAxon polar_surface_area 113.29 ChemAxon refractivity 104.98 ChemAxon polarizability 47.18 ChemAxon rotatable_bond_count 20 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 39409 Specdb::CMs 148976 Specdb::MsMs 25856 Specdb::MsMs 25857 Specdb::MsMs 25858 Specdb::MsMs 32414 Specdb::MsMs 32415 Specdb::MsMs 32416 Specdb::MsMs 1470973 Specdb::MsMs 2826214 Specdb::MsMs 2826215 Specdb::MsMs 2826216 Specdb::MsMs 2855533 Specdb::MsMs 2855534 Specdb::MsMs 2855535 C04036 Yurtsever D. (2007). Fatty acid methyl ester profiling of Enterococcus and Esherichia coli for microbial source tracking. M.sc. Thesis. Villanova University: U.S.A Glycerol-3-phosphate acyltransferase P0A7A7 PLSB_ECOLI plsB http://ecmdb.ca/proteins/P0A7A7.xml Phospholipase A1 P0A921 PA1_ECOLI pldA http://ecmdb.ca/proteins/P0A921.xml Acyl-CoA thioesterase I P0ADA1 TESA_ECOLI tesA http://ecmdb.ca/proteins/P0ADA1.xml 1-acyl-sn-glycerol-3-phosphate acyltransferase P26647 PLSC_ECOLI plsC http://ecmdb.ca/proteins/P26647.xml Probable glycerol-3-phosphate acyltransferase P60782 PLSY_ECOLI plsY http://ecmdb.ca/proteins/P60782.xml Acyl carrier protein P0A6A8 ACP_ECOLI acpP http://ecmdb.ca/proteins/P0A6A8.xml Glycerol 3-phosphate + Palmitoyl-ACP (n-C16:0ACP) > 1-hexadecanoyl-sn-glycerol 3-phosphate + acyl carrier protein 1-hexadecanoyl-sn-glycerol 3-phosphate + Water > Glycerol 3-phosphate + Hydrogen ion + Palmitic acid 1-hexadecanoyl-sn-glycerol 3-phosphate + Palmitoyl-ACP (n-C16:0ACP) > acyl carrier protein + PA(16:0/16:0) Glycerol 3-phosphate + Hexadecanoyl-phosphate (n-C16:0) > 1-hexadecanoyl-sn-glycerol 3-phosphate + Hydrogen ion + Phosphate Water + PA(16:0/16:0) > 1-hexadecanoyl-sn-glycerol 3-phosphate + Hydrogen ion + Palmitic acid