1.0 2020-03-26 01:25:25 UTC 2020-04-22 19:28:39 UTC BMDB0101268 TG(24:0/18:0/24:1(15Z)) 1-Lignoceroyl-2-stearoyl-3-nervonoyl-glycerol 1-Tetracosanoyl-2-octadecanoyl-3-(15Z-tetracosanoyl)-glycerol TAG(24:0/18:0/24:1) TAG(66:1) TG(24:0/18:0/24:1) TG(66:1) Tracylglycerol(24:0/18:0/24:1) Tracylglycerol(66:1) Triacylglycerol Triglyceride TG(24:0/18:0/24:1(15Z)) C69H132O6 1057.809 1057.00239197 (2S)-2-(octadecanoyloxy)-3-(tetracosanoyloxy)propyl (15Z)-tetracos-15-enoate (2S)-2-(octadecanoyloxy)-3-(tetracosanoyloxy)propyl (15Z)-tetracos-15-enoate [H][C@](COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCC\C=C/CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC InChI=1S/C69H132O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-41-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-40-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-42-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h25,28,66H,4-24,26-27,29-65H2,1-3H3/b28-25-/t66-/m1/s1 PUWIFYFOPBIWJD-LBWHNTCBSA-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 10.62 ALOGPS logs -7.97 ALOGPS logp 26.56 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac (2S)-2-(octadecanoyloxy)-3-(tetracosanoyloxy)propyl (15Z)-tetracos-15-enoate ChemAxon average_mass 1057.809 ChemAxon mono_mass 1057.00239197 ChemAxon smiles [H][C@](COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCC\C=C/CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC ChemAxon formula C69H132O6 ChemAxon inchi InChI=1S/C69H132O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-36-38-41-43-46-49-52-55-58-61-67(70)73-64-66(75-69(72)63-60-57-54-51-48-45-40-27-24-21-18-15-12-9-6-3)65-74-68(71)62-59-56-53-50-47-44-42-39-37-35-33-31-29-26-23-20-17-14-11-8-5-2/h25,28,66H,4-24,26-27,29-65H2,1-3H3/b28-25-/t66-/m1/s1 ChemAxon inchikey PUWIFYFOPBIWJD-LBWHNTCBSA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 325.22 ChemAxon polarizability 146.03 ChemAxon rotatable_bond_count 67 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 213917 Specdb::MsMs 587827 Specdb::MsMs 587828 Specdb::MsMs 587829 Specdb::MsMs 931696 Specdb::MsMs 931697 Specdb::MsMs 931698 Specdb::MsMs 2461879 Specdb::MsMs 2461880 Specdb::MsMs 2461881 Specdb::MsMs 2499809 Specdb::MsMs 2499810 Specdb::MsMs 2499811 Specdb::MsMs 2635168 Specdb::MsMs 2635169 Specdb::MsMs 2635170 Specdb::MsMs 2735558 Specdb::MsMs 2735559 Specdb::MsMs 2735560 Specdb::MsMs 2893955 Specdb::MsMs 2893956 Specdb::MsMs 2893957 131757929