1.0 2016-10-03 18:13:44 UTC 2020-04-22 15:42:58 UTC BMDB0011154 BMDB11154 LPA(P-16:0e/0:0) 1-(1Z-Hexadecenyl)-sn-glycero-3-phosphate 1-(1Z-Hexadecenyl)-glycero-3-phosphate 1-(1Z-Hexadecenyl)-lysophosphatidic acid LPA(16:1) LPA(p-16:0) LPA(p-16:0/0:0) LysoPA(16:1) LysoPA(p-16:0) Lysophosphatidic acid(16:1) Lysophosphatidic acid(p-16:0) Lysophosphatidic acid(p-16:0/0:0) LPA(O-16:1(1Z)) LPA(O-16:1(1Z)/0:0) LysoPA(O-16:1(1Z)) LysoPA(O-16:1(1Z)/0:0) Lysophosphatidic acid(O-16:1(1Z)) Lysophosphatidic acid(O-16:1(1Z)/0:0) LysoPA(P-16:0/0:0) C19H39O6P 394.4831 394.248425492 [(2R)-3-[(1Z)-hexadec-1-en-1-yloxy]-2-hydroxypropoxy]phosphonic acid (2R)-3-[(1Z)-hexadec-1-en-1-yloxy]-2-hydroxypropoxyphosphonic acid CCCCCCCCCCCCCC\C=C/OC[C@](O)([H])COP(=O)(O)O InChI=1S/C19H39O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-19(20)18-25-26(21,22)23/h15-16,19-20H,2-14,17-18H2,1H3,(H2,21,22,23)/b16-15-/t19-/m1/s1 LBGSRVIXIVDRQM-OAXWQBPPSA-N belongs to the class of organic compounds known as glycerophosphates. Glycerophosphates are compounds containing a glycerol linked to a phosphate group. Organic compounds Lipids and lipid-like molecules Glycerophospholipids Glycerophosphates Glycerophosphates Glycerol vinyl ethers Hydrocarbon derivatives Monoalkyl phosphates Organic oxides Secondary alcohols Alcohol Aliphatic acyclic compound Alkyl phosphate Glycerol vinyl ether Hydrocarbon derivative Monoalkyl phosphate Organic oxide Organic oxygen compound Organic phosphoric acid derivative Organooxygen compound Phosphoric acid ester Secondary alcohol Sn-glycerol-3-phosphate Aliphatic acyclic compounds 1Z-alkenylglycerophosphates Solid logp 4.81 ALOGPS logs -5.08 ALOGPS logp 5.35 ChemAxon pka_strongest_acidic 1.51 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac [(2R)-3-[(1Z)-hexadec-1-en-1-yloxy]-2-hydroxypropoxy]phosphonic acid ChemAxon average_mass 394.4831 ChemAxon mono_mass 394.248425492 ChemAxon smiles CCCCCCCCCCCCCC\C=C/OC[C@](O)([H])COP(=O)(O)O ChemAxon formula C19H39O6P ChemAxon inchi InChI=1S/C19H39O6P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-19(20)18-25-26(21,22)23/h15-16,19-20H,2-14,17-18H2,1H3,(H2,21,22,23)/b16-15-/t19-/m1/s1 ChemAxon inchikey LBGSRVIXIVDRQM-OAXWQBPPSA-N ChemAxon polar_surface_area 96.22 ChemAxon refractivity 105.32 ChemAxon polarizability 45.38 ChemAxon rotatable_bond_count 19 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -2 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 20922 Specdb::CMs 39569 Specdb::CMs 156812 Specdb::MsMs 312571 Specdb::MsMs 312572 Specdb::MsMs 312573 Specdb::MsMs 357856 Specdb::MsMs 357857 Specdb::MsMs 357858 Specdb::MsMs 2733285 Specdb::MsMs 2733286 Specdb::MsMs 2733287 Specdb::MsMs 2972547 Specdb::MsMs 2972548 Specdb::MsMs 2972549 24766520 52929772 FDB027929 C15646 BMDBP01572 Lysophosphatidic acid receptor 1 Q28031 LPAR1 Enzyme BMDBP01573 Lysophosphatidic acid receptor 5 Q3ZC80 LPAR5 Enzyme