1.0 2010-04-08 22:05:40 UTC 2019-11-26 02:58:30 UTC FDB003127 Glycerol 1,3-di-(9Z,12Z-octadecadienoate) 2-hexadecanoate Minor component of sunflower and other vegetable oils. Glycerol 1,3-di-(9Z,12Z-octadecadienoate) 2-hexadecanoate is found in fats and oils. 4-chloro-5,6-dihydroxy-indole-1-sulfonate 9,12-Octadecadienoic acid 2-[(1-oxohexadecyl)oxy]-1,3-propanediyl ester a,a'-Dilinoleopalmitin Berulide Glycerol 2-hexadecanoate 1,3-di-(9Z,12Z-octadecadienoate) C55H98O6 855.363 854.736340868 2-(hexadecanoyloxy)-3-[(9E,12E)-octadeca-9,12-dienoyloxy]propyl (9E,12E)-octadeca-9,12-dienoate 2-(hexadecanoyloxy)-3-[(9E,12E)-octadeca-9,12-dienoyloxy]propyl (9E,12E)-octadeca-9,12-dienoate 2190-16-1 CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCC\C=C\C\C=C\CCCCC)COC(=O)CCCCCCC\C=C\C\C=C\CCCCC InChI=1S/C55H98O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-28,52H,4-15,18,21-24,29-51H2,1-3H3/b19-16+,20-17+,27-25+,28-26+ KRVYYALDCAWYEF-OZBINYCYSA-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 Lineolic acids and 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 Octadecanoid Organic oxide Organic oxygen compound Organooxygen compound Triacyl-sn-glycerol Tricarboxylic acid or derivatives Liquid logp 10.75 ALOGPS logs -8.11 ALOGPS solubility 6.68e-06 g/l ALOGPS melting_point Mp -3° logp 19.25 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac 2-(hexadecanoyloxy)-3-[(9E,12E)-octadeca-9,12-dienoyloxy]propyl (9E,12E)-octadeca-9,12-dienoate ChemAxon average_mass 855.363 ChemAxon mono_mass 854.736340868 ChemAxon smiles CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCC\C=C\C\C=C\CCCCC)COC(=O)CCCCCCC\C=C\C\C=C\CCCCC ChemAxon formula C55H98O6 ChemAxon inchi InChI=1S/C55H98O6/c1-4-7-10-13-16-19-22-25-27-30-32-35-38-41-44-47-53(56)59-50-52(61-55(58)49-46-43-40-37-34-29-24-21-18-15-12-9-6-3)51-60-54(57)48-45-42-39-36-33-31-28-26-23-20-17-14-11-8-5-2/h16-17,19-20,25-28,52H,4-15,18,21-24,29-51H2,1-3H3/b19-16+,20-17+,27-25+,28-26+ ChemAxon inchikey KRVYYALDCAWYEF-OZBINYCYSA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 264.16 ChemAxon polarizability 111.14 ChemAxon rotatable_bond_count 50 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 674503 Specdb::MsMs 674504 Specdb::MsMs 674505 Specdb::MsMs 2526825 Specdb::MsMs 2526826 Specdb::MsMs 2526827 Specdb::MsMs 2781784 Specdb::MsMs 2781785 Specdb::MsMs 2781786 Specdb::MsMs 2840646 Specdb::MsMs 2840647 Specdb::MsMs 2840648 Specdb::MsMs 2927107 Specdb::MsMs 2927108 Specdb::MsMs 2927109 Specdb::MsMs 3063925 Specdb::MsMs 3063926 Specdb::MsMs 3063927 HMDB31118 #<Reference:0x000055ce314b5640> Fats and oils Unknown generic