2.0 2012-07-30 14:54:43 -0600 2015-06-03 17:20:46 -0600 ECMDB21161 M2MDB001570 2-hexadecanoyl-sn-glycerol 3-phosphate 2-hexadecanoyl-sn-glycerol 3-phosphate belongs to the class of Fatty Acid Esters. These are carboxylic ester derivatives of a fatty acid. (inferred from compound structure) 2-Hexadecanoyl-sn-glycerol 3-phosphoric acid C19H39O7P 410.4825 410.243340114 [2-(hexadecanoyloxy)-3-hydroxypropoxy]phosphonic acid 2-(hexadecanoyloxy)-3-hydroxypropoxyphosphonic acid CCCCCCCCCCCCCCCC(=O)OC(CO)COP(O)(O)=O InChI=1S/C19H39O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(21)26-18(16-20)17-25-27(22,23)24/h18,20H,2-17H2,1H3,(H2,22,23,24) LPQBQFLKBCPNAV-UHFFFAOYSA-N Membrane logp 3.96 ALOGPS logs -5.18 ALOGPS solubility 2.70e-03 g/l ALOGPS logp 4.96 ChemAxon pka_strongest_acidic 1.32 ChemAxon pka_strongest_basic -3 ChemAxon iupac [2-(hexadecanoyloxy)-3-hydroxypropoxy]phosphonic acid ChemAxon average_mass 410.4825 ChemAxon mono_mass 410.243340114 ChemAxon smiles CCCCCCCCCCCCCCCC(=O)OC(CO)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)26-18(16-20)17-25-27(22,23)24/h18,20H,2-17H2,1H3,(H2,22,23,24) ChemAxon inchikey LPQBQFLKBCPNAV-UHFFFAOYSA-N ChemAxon polar_surface_area 113.29 ChemAxon refractivity 104.98 ChemAxon polarizability 46.84 ChemAxon rotatable_bond_count 20 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 39405 Specdb::CMs 134995 Specdb::CMs 142729 Specdb::MsMs 25256 Specdb::MsMs 25257 Specdb::MsMs 25258 Specdb::MsMs 31814 Specdb::MsMs 31815 Specdb::MsMs 31816 Specdb::MsMs 2320781 Specdb::MsMs 2320782 Specdb::MsMs 2320783 Specdb::MsMs 2614294 Specdb::MsMs 2614295 Specdb::MsMs 2614296 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 Lysophospholipase L2 P07000 PLDB_ECOLI pldB http://ecmdb.ca/proteins/P07000.xml Phospholipase A1 P0A921 PA1_ECOLI pldA http://ecmdb.ca/proteins/P0A921.xml Lysophospholipid transporter lplT P39196 LPLT_ECOLI lplT http://ecmdb.ca/proteins/P39196.xml Water + PA(16:0/16:0) > 2-hexadecanoyl-sn-glycerol 3-phosphate + Palmitic acid 2-hexadecanoyl-sn-glycerol 3-phosphate + Water > Glycerol 3-phosphate +2 Hydrogen ion + Palmitic acid