1.0 2020-03-05 23:14:07 UTC 2020-05-21 16:29:19 UTC BMDB0074162 BMDB74162 TG(a-25:0/14:0/18:0)[rac] 1-anteisopentacosanoyl-2-myristoyl-3-stearoyl-glycerol TG(a-25:0/14:0/18:0) TG(57:0) Tag(a-25:0/14:0/18:0) Tag(57:0) Triacylglycerol(a-25:0/14:0/18:0) Triacylglycerol(57:0) Triacylglycerol Triglyceride 1-anteisopentacosanoyl-2-tetradecanoyl-3-octadecanoyl-glycerol TG(a-25:0/14:0/18:0)[rac] Tracylglycerol(a-25:0/14:0/18:0) Tracylglycerol(57:0) C60H116O6 933.582 932.877191455 (2R)-3-(octadecanoyloxy)-2-(tetradecanoyloxy)propyl 22-methyltetracosanoate (2R)-3-(octadecanoyloxy)-2-(tetradecanoyloxy)propyl 22-methyltetracosanoate [H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCCCCCC(C)CC)OC(=O)CCCCCCCCCCCCC InChI=1S/C60H116O6/c1-5-8-10-12-14-16-18-19-24-28-32-35-39-43-47-51-58(61)64-54-57(66-60(63)53-49-45-41-37-30-17-15-13-11-9-6-2)55-65-59(62)52-48-44-40-36-33-29-26-23-21-20-22-25-27-31-34-38-42-46-50-56(4)7-3/h56-57H,5-55H2,1-4H3/t56?,57-/m1/s1 CLOGPJBRRKWIAD-PRGMGZSTSA-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 -7.93 ALOGPS logp 22.77 ChemAxon pka_strongest_basic -6.6 ChemAxon iupac (2R)-3-(octadecanoyloxy)-2-(tetradecanoyloxy)propyl 22-methyltetracosanoate ChemAxon average_mass 933.582 ChemAxon mono_mass 932.877191455 ChemAxon smiles [H][C@@](COC(=O)CCCCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCCCCCCCC(C)CC)OC(=O)CCCCCCCCCCCCC ChemAxon formula C60H116O6 ChemAxon inchi InChI=1S/C60H116O6/c1-5-8-10-12-14-16-18-19-24-28-32-35-39-43-47-51-58(61)64-54-57(66-60(63)53-49-45-41-37-30-17-15-13-11-9-6-2)55-65-59(62)52-48-44-40-36-33-29-26-23-21-20-22-25-27-31-34-38-42-46-50-56(4)7-3/h56-57H,5-55H2,1-4H3/t56?,57-/m1/s1 ChemAxon inchikey CLOGPJBRRKWIAD-PRGMGZSTSA-N ChemAxon polar_surface_area 78.9 ChemAxon refractivity 282.65 ChemAxon polarizability 128.2 ChemAxon rotatable_bond_count 58 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::MsMs 660103 Specdb::MsMs 660104 Specdb::MsMs 660105 Specdb::MsMs 2342805 Specdb::MsMs 2342806 Specdb::MsMs 2342807 Specdb::MsMs 2425741 Specdb::MsMs 2425742 Specdb::MsMs 2425743 Specdb::MsMs 2426593 Specdb::MsMs 2426594 Specdb::MsMs 2426595 Specdb::MsMs 2511645 Specdb::MsMs 2511646 Specdb::MsMs 2511647 Specdb::MsMs 2987798 Specdb::MsMs 2987799 Specdb::MsMs 2987800 FDB042786 131777666 BMDBP02834 Diacylglycerol O-acyltransferase 1 Q8MK44 DGAT1 Enzyme