1.0 2016-09-30 23:10:10 UTC 2020-04-22 15:14:00 UTC BMDB0004680 BMDB04680 16(R)-HETE (16R,5Z,8Z,11Z,14Z)-16-Hydroxy-5,8,11,14-eicosatetraenoic acid (5Z,8Z,11Z,14Z)-(16R)-16-Hydroxyeicosa-5,8,11,14-tetraenoic acid (5Z,8Z,11Z,14Z)-(16R)-16-Hydroxyicosa-5,8,11,14-tetraenoic acid (5Z,8Z,11Z,14Z,16R)-16-Hydroxyeicosa-5,8,11,14-tetraenoic acid (all-cis)-16(R)-Hydroxy-5,8,11,14-eicosatetraenoic acid (all-Z)-16(R)-Hydroxy-5,8,11,14-eicosatetraenoic acid 16(R)-Hydroxy-all-cis-5,8,11,14-eicosatetraenoic acid 16(R)-Hydroxyeicosa-5(Z),8(Z),11(Z),14(Z)-tetraenoic acid (16R,5Z,8Z,11Z,14Z)-16-Hydroxy-5,8,11,14-eicosatetraenoate (5Z,8Z,11Z,14Z)-(16R)-16-Hydroxyeicosa-5,8,11,14-tetraenoate (5Z,8Z,11Z,14Z)-(16R)-16-Hydroxyicosa-5,8,11,14-tetraenoate (5Z,8Z,11Z,14Z,16R)-16-Hydroxyeicosa-5,8,11,14-tetraenoate (all-cis)-16(R)-Hydroxy-5,8,11,14-eicosatetraenoate (all-Z)-16(R)-Hydroxy-5,8,11,14-eicosatetraenoate 16(R)-Hydroxy-all-cis-5,8,11,14-eicosatetraenoate 16(R)-Hydroxyeicosa-5(Z),8(Z),11(Z),14(Z)-tetraenoate 16-HETE 16R-HETE 16R-Hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoate 16R-Hydroxy-5Z,8Z,11Z,14Z-eicosatetraenoic acid C20H32O3 320.4663 320.23514489 (5Z,8Z,11Z,14Z,16R)-16-hydroxyicosa-5,8,11,14-tetraenoic acid 16R-hete CCCC[C@@H](O)\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O InChI=1S/C20H32O3/c1-2-3-16-19(21)17-14-12-10-8-6-4-5-7-9-11-13-15-18-20(22)23/h4-5,8-11,14,17,19,21H,2-3,6-7,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,17-14-/t19-/m1/s1 JEKNPVYFNMZRJG-STHMYGMFSA-N belongs to the class of organic compounds known as hydroxyeicosatetraenoic acids. These are eicosanoic acids with an attached hydroxyl group and four CC double bonds. Organic compounds Lipids and lipid-like molecules Fatty Acyls Eicosanoids Hydroxyeicosatetraenoic acids Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Hydroxy fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Organic oxides Secondary alcohols Unsaturated fatty acids Alcohol Aliphatic acyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Fatty acid Hydrocarbon derivative Hydroxy fatty acid Hydroxyeicosatetraenoic acid Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Unsaturated fatty acid Aliphatic acyclic compounds 16-HETE Hydroxy/hydroperoxyeicosatetraenoic acids Hydroxy/hydroperoxyeicosatetraenoic acids Solid logp 5.77 ALOGPS logs -5.21 ALOGPS logp 5.36 ChemAxon pka_strongest_acidic 4.82 ChemAxon pka_strongest_basic -1.6 ChemAxon iupac (5Z,8Z,11Z,14Z,16R)-16-hydroxyicosa-5,8,11,14-tetraenoic acid ChemAxon average_mass 320.4663 ChemAxon mono_mass 320.23514489 ChemAxon smiles CCCC[C@@H](O)\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O ChemAxon formula C20H32O3 ChemAxon inchi InChI=1S/C20H32O3/c1-2-3-16-19(21)17-14-12-10-8-6-4-5-7-9-11-13-15-18-20(22)23/h4-5,8-11,14,17,19,21H,2-3,6-7,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,17-14-/t19-/m1/s1 ChemAxon inchikey JEKNPVYFNMZRJG-STHMYGMFSA-N ChemAxon polar_surface_area 57.53 ChemAxon refractivity 101.47 ChemAxon polarizability 37.28 ChemAxon rotatable_bond_count 14 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 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 Arachidonic Acid Metabolism SMP0087220 Specdb::CMs 12284 Specdb::CMs 38786 Specdb::CMs 134663 Specdb::CMs 142397 Specdb::MsMs 293095 Specdb::MsMs 293096 Specdb::MsMs 293097 Specdb::MsMs 333496 Specdb::MsMs 333497 Specdb::MsMs 333498 Specdb::MsMs 2445598 Specdb::MsMs 2445599 Specdb::MsMs 2445600 Specdb::MsMs 2517192 Specdb::MsMs 2517193 Specdb::MsMs 2517194 7827807 9548884 C14778 34162 FDB023401