1.0 2016-09-30 23:37:15 UTC 2020-05-21 16:28:01 UTC BMDB0007433 BMDB07433 DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2], also known as dg(20:2(11z,14z)/20:5(5z,8z,11z,14z,17z)/0:0)[iso2] or DAG(20:2/20:5), belongs to the class of organic compounds known as 1,2-dg(20:2(11z,14z)/20:5(5z,8z,11z,14z,17z)/0:0)[iso2]s. These are dg(20:2(11z,14z)/20:5(5z,8z,11z,14z,17z)/0:0)[iso2]s containing a glycerol acylated at positions 1 and 2. Thus, DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2] is considered to be a diradylglycerol lipid molecule. DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2] is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. In cattle, DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0)[iso2] is involved in a few metabolic pathways, which include de novo triacylglycerol biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:0) pathway, de novo triacylglycerol biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) pathway, and de novo triacylglycerol biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/24:0) pathway. 1-Eicosadienoyl-2-eicosapentaenoyl-sn-glycerol DAG(20:2/20:5) DAG(20:2N6/20:5N3) DAG(20:2W6/20:5W3) DAG(40:7) DG(20:2/20:5) DG(20:2N6/20:5N3) DG(20:2W6/20:5W3) DG(40:7) Diacylglycerol Diacylglycerol(20:2/20:5) Diacylglycerol(20:2n6/20:5n3) Diacylglycerol(20:2W6/20:5W3) Diacylglycerol(40:7) Diglyceride 1-(11Z,14Z-Eicosadienoyl)-2-(5Z,8Z,11Z,14Z,17Z-eicosapentaenoyl)-sn-glycerol DG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/0:0) C43H70O5 667.0129 666.52232535 (2S)-1-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate diacylglycerol [H][C@](CO)(COC(=O)CCCCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC InChI=1S/C43H70O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-40-41(39-44)48-43(46)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,24,26,30,32,41,44H,3-5,7,9-10,15-16,21-23,25,27-29,31,33-40H2,1-2H3/b8-6-,13-11-,14-12-,19-17-,20-18-,26-24-,32-30-/t41-/m0/s1 SGRGWEJJBSSTNQ-ORLHYVSVSA-N belongs to the class of organic compounds known as 1,2-diacylglycerols. These are diacylglycerols containing a glycerol acylated at positions 1 and 2. Organic compounds Lipids and lipid-like molecules Glycerolipids Diradylglycerols 1,2-diacylglycerols Carbonyl compounds Carboxylic acid esters Dicarboxylic acids and derivatives Fatty acid esters Hydrocarbon derivatives Organic oxides Primary alcohols 1,2-acyl-sn-glycerol Alcohol Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dicarboxylic acid or derivatives Fatty acid ester Fatty acyl Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Primary alcohol Aliphatic acyclic compounds Diacylglycerols Solid logp 9.12 ALOGPS logs -7.69 ALOGPS logp 13.03 ChemAxon pka_strongest_acidic 14.58 ChemAxon pka_strongest_basic -3 ChemAxon iupac (2S)-1-hydroxy-3-[(11Z,14Z)-icosa-11,14-dienoyloxy]propan-2-yl (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate ChemAxon average_mass 667.0129 ChemAxon mono_mass 666.52232535 ChemAxon smiles [H][C@](CO)(COC(=O)CCCCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC ChemAxon formula C43H70O5 ChemAxon inchi InChI=1S/C43H70O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(45)47-40-41(39-44)48-43(46)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,24,26,30,32,41,44H,3-5,7,9-10,15-16,21-23,25,27-29,31,33-40H2,1-2H3/b8-6-,13-11-,14-12-,19-17-,20-18-,26-24-,32-30-/t41-/m0/s1 ChemAxon inchikey SGRGWEJJBSSTNQ-ORLHYVSVSA-N ChemAxon polar_surface_area 72.83 ChemAxon refractivity 212.32 ChemAxon polarizability 82.45 ChemAxon rotatable_bond_count 35 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 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/20:5(5Z,8Z,11Z,14Z,17Z)) SMP0076536 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:0) SMP0076537 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:1(13Z)) SMP0076538 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:2(13Z,16Z)) SMP0076539 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:4(7Z,10Z,13Z,16Z)) SMP0076540 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(4Z,7Z,10Z,13Z,16Z)) SMP0076541 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:5(7Z,10Z,13Z,16Z,19Z)) SMP0076542 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/22:6(4Z,7Z,10Z,13Z,16Z,19Z)) SMP0076543 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/24:0) SMP0076544 De Novo Triacylglycerol Biosynthesis TG(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)/24:1(15Z)) SMP0076545 Phosphatidylcholine Biosynthesis PC(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) SMP0080750 Phosphatidylethanolamine Biosynthesis PE(20:2(11Z,14Z)/20:5(5Z,8Z,11Z,14Z,17Z)) SMP0082558 Specdb::MsMs 322858 Specdb::MsMs 322859 Specdb::MsMs 322860 Specdb::MsMs 370876 Specdb::MsMs 370877 Specdb::MsMs 370878 Specdb::MsMs 2334250 Specdb::MsMs 2334251 Specdb::MsMs 2334252 Specdb::MsMs 2746085 Specdb::MsMs 2746086 Specdb::MsMs 2746087 Specdb::MsMs 2936653 Specdb::MsMs 2936654 Specdb::MsMs 2936655 Specdb::MsMs 2995634 Specdb::MsMs 2995635 Specdb::MsMs 2995636 Specdb::CMs 25661 Specdb::CMs 700186 Specdb::CMs 700187 All Tissues Wishart DS, Feunang YD, Marcu A, Guo AC, Liang K, Vazquez-Fresno R, Sajed T, Johnson D, Li C, Karu N, Sayeeda Z, Lo E, Assempour N, Berjanskii M, Singhal S, Arndt D, Liang Y, Badran H, Grant J, Serra-Cayuela A, Liu Y, Mandal R, Neveu V, Pon A, Knox C, Wilson M, Manach C, Scalbert A: HMDB 4.0: the human metabolome database for 2018. Nucleic Acids Res. 2018 Jan 4;46(D1):D608-D617. doi: 10.1093/nar/gkx1089. 29140435 9543863 7822813 89042 FDB024626 BMDBP00391 Ethanolaminephosphotransferase 1 Q17QM4 SELENOI Enzyme BMDBP02834 Diacylglycerol O-acyltransferase 1 Q8MK44 DGAT1 Enzyme