1.0 2020-03-25 15:59:29 UTC 2020-04-22 18:59:19 UTC BMDB0096626 DG(20:2n6/0:0/20:4n6) (2R)-2-Hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid Diacylglycerol(40:6) Diacylglycerol(20:2W6/0:0/20:4W6) DG(20:2/0:0/20:4) DAG(20:2N6/0:0/20:4N6) DAG(20:2/0:0/20:4) DAG(40:6) 1-Eicosadienoyl-3-arachidonoyl-sn-glycerol Diglyceride DG(40:6) DG(20:2W6/0:0/20:4W6) Diacylglycerol DAG(20:2W6/0:0/20:4W6) Diacylglycerol(20:2/0:0/20:4) 1-(11Z,14Z-Eicosadienoyl)-3-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-sn-glycerol Diacylglycerol(20:2n6/0:0/20:4n6) DG(20:2n6/0:0/20:4n6) C43H72O5 669.044 668.537975418 (2R)-2-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate (2R)-2-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate [H][C@@](O)(COC(=O)CCCCCCCCC\C=C/C\C=C/CCCCC)COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC InChI=1S/C43H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-39-41(44)40-48-43(46)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23,25,29,31,41,44H,3-10,15-16,21-22,24,26-28,30,32-40H2,1-2H3/b13-11-,14-12-,19-17-,20-18-,25-23-,31-29-/t41-/m0/s1 ODIFDYMVTZMQLS-SZDMVCCJSA-N belongs to the class of organic compounds known as other hydroxyeicosapolyenoic acids. These are hydroxyeicosapolyenoic acids which do not belong to the Hydroxyeicosapentaenoic acids, the Hydroxyeicosatetraenoic acids, or the Hydroxyeicosatrienoic acids. Organic compounds Lipids and lipid-like molecules Fatty Acyls Eicosanoids Other hydroxyeicosapolyenoic acids 1,3-diacylglycerols Carbonyl compounds Carboxylic acid esters Dicarboxylic acids and derivatives Fatty acid esters Hydrocarbon derivatives Organic oxides Secondary alcohols 1,3-acyl-sn-glycerol Alcohol Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Diacylglycerol Dicarboxylic acid or derivatives Diradylglycerol Fatty acid ester Glycerolipid Hydrocarbon derivative Hydroxyeicosapolyenoic acid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Aliphatic acyclic compounds logp 9.69 ALOGPS logs -7.73 ALOGPS logp 13.39 ChemAxon pka_strongest_acidic 13.63 ChemAxon pka_strongest_basic -3.4 ChemAxon iupac (2R)-2-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propyl (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoate ChemAxon average_mass 669.044 ChemAxon mono_mass 668.537975418 ChemAxon smiles [H][C@@](O)(COC(=O)CCCCCCCCC\C=C/C\C=C/CCCCC)COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC ChemAxon formula C43H72O5 ChemAxon inchi InChI=1S/C43H72O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-39-41(44)40-48-43(46)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23,25,29,31,41,44H,3-10,15-16,21-22,24,26-28,30,32-40H2,1-2H3/b13-11-,14-12-,19-17-,20-18-,25-23-,31-29-/t41-/m0/s1 ChemAxon inchikey ODIFDYMVTZMQLS-SZDMVCCJSA-N ChemAxon polar_surface_area 72.83 ChemAxon refractivity 211.21 ChemAxon polarizability 85.61 ChemAxon rotatable_bond_count 36 ChemAxon acceptor_count 3 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 701665 Specdb::CMs 701666 Specdb::MsMs 1226458 Specdb::MsMs 1226459 Specdb::MsMs 1226460 Specdb::MsMs 1342051 Specdb::MsMs 1342052 Specdb::MsMs 1342053 Specdb::MsMs 2763892 Specdb::MsMs 2763893 Specdb::MsMs 2763894 Specdb::MsMs 2941136 Specdb::MsMs 2941137 Specdb::MsMs 2941138 74854656 131802010 FDB098771