1.0 2020-03-26 01:27:01 UTC 2020-04-22 19:28:46 UTC BMDB0101287 TG(24:0/20:0/18:1(11Z)) 1-Lignoceroyl-2-arachidonyl-3-vaccenoyl-glycerol 1-Tetracosanoyl-2-eicosanoyl-3-(11Z-octadecenoyl)-glycerol TAG(24:0/20:0/18:1) TAG(62:1) TG(24:0/20:0/18:1) TG(62:1) Tracylglycerol(24:0/20:0/18:1) Tracylglycerol(62:1) Triacylglycerol Triglyceride TG(24:0/20:0/18:1(11Z)) C65H124O6 1001.701 1000.939791713 (2S)-2-(icosanoyloxy)-3-[(11Z)-octadec-11-enoyloxy]propyl tetracosanoate (2S)-2-(icosanoyloxy)-3-[(11Z)-octadec-11-enoyloxy]propyl tetracosanoate [H][C@](COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCC\C=C/CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC InChI=1S/C65H124O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-35-37-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-38-34-29-26-23-20-17-14-11-8-5-2/h21,24,62H,4-20,22-23,25-61H2,1-3H3/b24-21-/t62-/m1/s1 CHNSYYLJCHQSIA-QMNOEWNESA-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 10.68 ALOGPS logs -7.96 ALOGPS logp 24.79 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac (2S)-2-(icosanoyloxy)-3-[(11Z)-octadec-11-enoyloxy]propyl tetracosanoate ChemAxon average_mass 1001.701 ChemAxon mono_mass 1000.939791713 ChemAxon smiles [H][C@](COC(=O)CCCCCCCCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCC\C=C/CCCCCC)OC(=O)CCCCCCCCCCCCCCCCCCC ChemAxon formula C65H124O6 ChemAxon inchi InChI=1S/C65H124O6/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-35-37-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-38-34-29-26-23-20-17-14-11-8-5-2/h21,24,62H,4-20,22-23,25-61H2,1-3H3/b24-21-/t62-/m1/s1 ChemAxon inchikey CHNSYYLJCHQSIA-QMNOEWNESA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 306.82 ChemAxon polarizability 137.82 ChemAxon rotatable_bond_count 63 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 220223 Specdb::MsMs 626023 Specdb::MsMs 626024 Specdb::MsMs 626025 Specdb::MsMs 947065 Specdb::MsMs 947066 Specdb::MsMs 947067 Specdb::MsMs 2351488 Specdb::MsMs 2351489 Specdb::MsMs 2351490 Specdb::MsMs 2553736 Specdb::MsMs 2553737 Specdb::MsMs 2553738 Specdb::MsMs 2584229 Specdb::MsMs 2584230 Specdb::MsMs 2584231 Specdb::MsMs 2759987 Specdb::MsMs 2759988 Specdb::MsMs 2759989 Specdb::MsMs 3067505 Specdb::MsMs 3067506 Specdb::MsMs 3067507 131757948