1.0 2016-10-03 18:13:38 UTC 2020-04-22 15:42:56 UTC BMDB0011149 BMDB11149 LysoPC(O-18:0) 1-O-Octadecylglycerol-3-phosphatidylcholine 1-Octadecyl-sn-glycero-3-phosphocholine 1-Stearyl-GPC 1-Stearyl-GPC (O-18:0) GPC(O-18:0) GPC(O-18:0/0:0) LPC (O-18:0) LysoPC(18:0E/0:0) LysoPC(O-18:0) PC(O-18:0/0:0) LysoPC(DM18:0) 1-O-Octadecyl-sn-glycero-3-phosphocholine 1-O-Octadecyl-sn-glyceryl-3-phosphorylcholine 1-Octadecyl-GPC 1-Octadecyl-lysophosphatidylcholine 1-Octadecylglycero-3-phosphocholine GPC(18:0) GPC(18:0/0:0) LPC(18:0) LPC(18:0/0:0) LPC(O-18:0) LPC(O-18:0/0:0) Lyso-platelet-activating factor LysoPC(18:0) LysoPC(18:0/0:0) Lysophosphatidylcholine(18:0) Lysophosphatidylcholine(18:0/0:0) Lysophosphatidylcholine(O-18:0) Lysophosphatidylcholine(O-18:0/0:0) LysoPC(O-18:0/0:0) C26H56NO6P 509.6997 509.384525041 (2-{[(2R)-2-hydroxy-3-(octadecyloxy)propyl phosphono]oxy}ethyl)trimethylazanium (2-{[(2R)-2-hydroxy-3-(octadecyloxy)propyl phosphono]oxy}ethyl)trimethylazanium 74430-89-0 CCCCCCCCCCCCCCCCCCOC[C@@H](O)COP([O-])(=O)OCC[N+](C)(C)C InChI=1S/C26H56NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h26,28H,5-25H2,1-4H3/t26-/m1/s1 XKBJVQHMEXMFDZ-AREMUKBSSA-N belongs to the class of organic compounds known as monoalkylglycerophosphocholines. Monoalkylglycerophosphocholines are compounds containing glycerophosphocholine moiety attached to an fatty acyl chain through an ether bond. Organic compounds Lipids and lipid-like molecules Glycerophospholipids Glycerophosphocholines Monoalkylglycerophosphocholines Amines Dialkyl ethers Dialkyl phosphates Glycerol ethers Hydrocarbon derivatives Organic oxides Organic salts Organopnictogen compounds Phosphocholines Secondary alcohols Tetraalkylammonium salts Alcohol Aliphatic acyclic compound Alkyl phosphate Amine Dialkyl ether Dialkyl phosphate Ether Glycerol ether Hydrocarbon derivative Monoalkylglycerophosphocholine Organic nitrogen compound Organic oxide Organic oxygen compound Organic phosphoric acid derivative Organic salt Organonitrogen compound Organooxygen compound Organopnictogen compound Phosphocholine Phosphoric acid ester Quaternary ammonium salt Secondary alcohol Tetraalkylammonium salt Aliphatic acyclic compounds 1-alkyl-sn-glycero-3-phosphocholine Monoalkylglycerophosphocholines organic molecular entity Solid logp 2.98 ALOGPS logs -6.32 ALOGPS logp 2.46 ChemAxon pka_strongest_acidic 1.86 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac (2-{[(2R)-2-hydroxy-3-(octadecyloxy)propyl phosphono]oxy}ethyl)trimethylazanium ChemAxon average_mass 509.6997 ChemAxon mono_mass 509.384525041 ChemAxon smiles CCCCCCCCCCCCCCCCCCOC[C@@H](O)COP([O-])(=O)OCC[N+](C)(C)C ChemAxon formula C26H56NO6P ChemAxon inchi InChI=1S/C26H56NO6P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-31-24-26(28)25-33-34(29,30)32-23-21-27(2,3)4/h26,28H,5-25H2,1-4H3/t26-/m1/s1 ChemAxon inchikey XKBJVQHMEXMFDZ-AREMUKBSSA-N ChemAxon polar_surface_area 88.05 ChemAxon refractivity 151.72 ChemAxon polarizability 62.7 ChemAxon rotatable_bond_count 26 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 0 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 20482 Specdb::CMs 39565 Specdb::MsMs 311599 Specdb::MsMs 311600 Specdb::MsMs 311601 Specdb::MsMs 356638 Specdb::MsMs 356639 Specdb::MsMs 356640 Specdb::MsMs 2401205 Specdb::MsMs 2401206 Specdb::MsMs 2401207 Specdb::MsMs 2434867 Specdb::MsMs 2434868 Specdb::MsMs 2434869 Specdb::MsMs 2469451 Specdb::MsMs 2469452 Specdb::MsMs 2469453 Specdb::MsMs 2504549 Specdb::MsMs 2504550 Specdb::MsMs 2504551 2015318 2733532 75216 FDB027924 C04317