1.0 2020-03-26 01:57:00 UTC 2020-04-22 19:31:02 UTC BMDB0101644 TG(24:0/20:4(5Z,8Z,11Z,14Z)/24:0) Tracylglycerol(68:4) Triacylglycerol Tracylglycerol(24:0/20:4/24:0) 1-Lignoceroyl-2-arachidonoyl-3-lignoceroyl-glycerol Triglyceride TG(24:0/20:4/24:0) TAG(24:0/20:4/24:0) TG(68:4) 1-Tetracosanoyl-2-(5Z,8Z,11Z,14Z-eicosatetraenoyl)-3-tetracosanoyl-glycerol TAG(68:4) TG(24:0/20:4(5Z,8Z,11Z,14Z)/24:0) C71H130O6 1079.7883 1078.986741892 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-(tetracosanoyloxy)propyl tetracosanoate 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-(tetracosanoyloxy)propyl tetracosanoate [H]C(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC InChI=1S/C71H130O6/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-40-42-45-48-51-54-57-60-63-69(72)75-66-68(77-71(74)65-62-59-56-53-50-47-44-39-30-27-24-21-18-15-12-9-6-3)67-76-70(73)64-61-58-55-52-49-46-43-41-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h18,21,27,30,44,47,53,56,68H,4-17,19-20,22-26,28-29,31-43,45-46,48-52,54-55,57-67H2,1-3H3/b21-18-,30-27-,47-44-,56-53- ZOORSJANVIRRQZ-IIYSTXCBSA-N belongs to the class of organic compounds known as triacylglycerols. These are glycerides consisting of three fatty acid chains covalently bonded to a glycerol molecule through ester linkages. Organic compounds Lipids and lipid-like molecules Glycerolipids Triradylcglycerols Triacylglycerols Carbonyl compounds Carboxylic acid esters Fatty acid esters Hydrocarbon derivatives Organic oxides Tricarboxylic acids and derivatives Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Fatty acyl Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Triacyl-sn-glycerol Tricarboxylic acid or derivatives Aliphatic acyclic compounds logp 10.85 ALOGPS logs -8.22 ALOGPS logp 26.37 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac 2-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyloxy]-3-(tetracosanoyloxy)propyl tetracosanoate ChemAxon average_mass 1079.7883 ChemAxon mono_mass 1078.986741892 ChemAxon smiles [H]C(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC ChemAxon formula C71H130O6 ChemAxon inchi InChI=1S/C71H130O6/c1-4-7-10-13-16-19-22-25-28-31-33-35-37-40-42-45-48-51-54-57-60-63-69(72)75-66-68(77-71(74)65-62-59-56-53-50-47-44-39-30-27-24-21-18-15-12-9-6-3)67-76-70(73)64-61-58-55-52-49-46-43-41-38-36-34-32-29-26-23-20-17-14-11-8-5-2/h18,21,27,30,44,47,53,56,68H,4-17,19-20,22-26,28-29,31-43,45-46,48-52,54-55,57-67H2,1-3H3/b21-18-,30-27-,47-44-,56-53- ChemAxon inchikey ZOORSJANVIRRQZ-IIYSTXCBSA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 337.78 ChemAxon polarizability 146.93 ChemAxon rotatable_bond_count 66 ChemAxon acceptor_count 3 ChemAxon donor_count 0 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 232754 Specdb::MsMs 684574 Specdb::MsMs 684575 Specdb::MsMs 684576 Specdb::MsMs 2418538 Specdb::MsMs 2418539 Specdb::MsMs 2418540 Specdb::MsMs 2574328 Specdb::MsMs 2574329 Specdb::MsMs 2574330 Specdb::MsMs 2780635 Specdb::MsMs 2780636 Specdb::MsMs 2780637 Specdb::MsMs 3042799 Specdb::MsMs 3042800 Specdb::MsMs 3042801 Specdb::MsMs 3097342 Specdb::MsMs 3097343 Specdb::MsMs 3097344 131758304