1.0 2010-04-08 22:12:59 UTC 2019-11-26 03:14:34 UTC FDB017270 Glycerol 1-(9Z-octadecenoate) 2-octanoate 3-tetradecanoate Isolated from palm kernel oil. Glycerol 1-(9Z-octadecenoate) 2-octanoate 3-tetradecanoate is found in fats and oils. 2-Caprylooleomyristin a-Oleo-b-caprylo-a'-myristin Glycerol 2-octanoate 1-(9Z-octadecenoate) 3-tetradecanoate C43H80O6 693.0917 692.595490292 2-(octanoyloxy)-3-(tetradecanoyloxy)propyl (9E)-octadec-9-enoate 2-(octanoyloxy)-3-(tetradecanoyloxy)propyl (9E)-octadec-9-enoate CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC\C=C\CCCCCCCC)OC(=O)CCCCCCC InChI=1S/C43H80O6/c1-4-7-10-13-15-17-19-20-21-22-24-26-28-31-33-36-42(45)48-39-40(49-43(46)37-34-29-12-9-6-3)38-47-41(44)35-32-30-27-25-23-18-16-14-11-8-5-2/h20-21,40H,4-19,22-39H2,1-3H3/b21-20+ POKDRGLHIVFRJS-QZQOTICOSA-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. Triacylglycerols Organic compounds Lipids and lipid-like molecules Glycerolipids Triradylcglycerols Aliphatic acyclic compounds 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 Liquid logp 10.19 ALOGPS logs -7.78 ALOGPS solubility 1.14e-05 g/l ALOGPS melting_point Mp 14.8° logp 15.01 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac 2-(octanoyloxy)-3-(tetradecanoyloxy)propyl (9E)-octadec-9-enoate ChemAxon average_mass 693.0917 ChemAxon mono_mass 692.595490292 ChemAxon smiles CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC\C=C\CCCCCCCC)OC(=O)CCCCCCC ChemAxon formula C43H80O6 ChemAxon inchi InChI=1S/C43H80O6/c1-4-7-10-13-15-17-19-20-21-22-24-26-28-31-33-36-42(45)48-39-40(49-43(46)37-34-29-12-9-6-3)38-47-41(44)35-32-30-27-25-23-18-16-14-11-8-5-2/h20-21,40H,4-19,22-39H2,1-3H3/b21-20+ ChemAxon inchikey POKDRGLHIVFRJS-QZQOTICOSA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 205.6 ChemAxon polarizability 91.28 ChemAxon rotatable_bond_count 41 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 614716 Specdb::MsMs 614717 Specdb::MsMs 614718 Specdb::MsMs 2317358 Specdb::MsMs 2317359 Specdb::MsMs 2317360 Specdb::MsMs 2409220 Specdb::MsMs 2409221 Specdb::MsMs 2409222 Specdb::MsMs 2727197 Specdb::MsMs 2727198 Specdb::MsMs 2727199 Specdb::MsMs 2955447 Specdb::MsMs 2955448 Specdb::MsMs 2955449 Specdb::MsMs 2978222 Specdb::MsMs 2978223 Specdb::MsMs 2978224 HMDB38059 #<Reference:0x000055ce33334580> Fats and oils Unknown generic