1.0 2016-09-30 22:54:20 UTC 2020-05-21 16:28:40 UTC BMDB0002343 BMDB02343 5,6-DHET (+/-)5,6-dihetre (8Z,11Z,14Z)-5,6-Dihydroxyeicosa-8,11,14-trienoic acid (8Z,11Z,14Z)-5,6-Dihydroxyicosa-8,11,14-trienoic acid 5,6-DiHETrE 5,6-Dihydroxy-8Z,11Z,14Z-eicosatrienoic acid 5,6-Dihydroxy-8Z,11Z,14Z-icosatrienoic acid (8Z,11Z,14Z)-5,6-Dihydroxyeicosa-8,11,14-trienoate (8Z,11Z,14Z)-5,6-Dihydroxyicosa-8,11,14-trienoate 5,6-Dihydroxy-8Z,11Z,14Z-eicosatrienoate 5,6-Dihydroxy-8Z,11Z,14Z-icosatrienoate C20H34O4 338.4816 338.245709576 (8Z,11Z,14Z)-5,6-dihydroxyicosa-8,11,14-trienoic acid 5,6-DiHETrE 213382-49-1 CCCCC\C=C/C\C=C/C\C=C/CC(O)C(O)CCCC(O)=O InChI=1S/C20H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h6-7,9-10,12-13,18-19,21-22H,2-5,8,11,14-17H2,1H3,(H,23,24)/b7-6-,10-9-,13-12- GFNYAPAJUNPMGH-QNEBEIHSSA-N belongs to the class of organic compounds known as hydroxyeicosatrienoic acids. These are eicosanoic acids with an attached hydroxyl group and three CC double bonds. Organic compounds Lipids and lipid-like molecules Fatty Acyls Eicosanoids Hydroxyeicosatrienoic acids 1,2-diols Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Hydroxy fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Organic oxides Secondary alcohols Unsaturated fatty acids 1,2-diol Alcohol Aliphatic acyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Fatty acid Hydrocarbon derivative Hydroxy fatty acid Hydroxyeicosatrienoic acid Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Unsaturated fatty acid Aliphatic acyclic compounds DHET Hydroxy/hydroperoxyeicosatrienoic acids Hydroxy/hydroperoxyeicosatrienoic acids Solid logp 5.42 ALOGPS logs -4.40 ALOGPS logp 4.49 ChemAxon pka_strongest_acidic 4.45 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac (8Z,11Z,14Z)-5,6-dihydroxyicosa-8,11,14-trienoic acid ChemAxon average_mass 338.4816 ChemAxon mono_mass 338.245709576 ChemAxon smiles CCCCC\C=C/C\C=C/C\C=C/CC(O)C(O)CCCC(O)=O ChemAxon formula C20H34O4 ChemAxon inchi InChI=1S/C20H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h6-7,9-10,12-13,18-19,21-22H,2-5,8,11,14-17H2,1H3,(H,23,24)/b7-6-,10-9-,13-12- ChemAxon inchikey GFNYAPAJUNPMGH-QNEBEIHSSA-N ChemAxon polar_surface_area 77.76 ChemAxon refractivity 101.87 ChemAxon polarizability 39.75 ChemAxon rotatable_bond_count 15 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon number_of_rings 0 ChemAxon bioavailability 1 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 23745 Specdb::CMs 38378 Specdb::CMs 151980 Specdb::MsMs 318643 Specdb::MsMs 318644 Specdb::MsMs 318645 Specdb::MsMs 365482 Specdb::MsMs 365483 Specdb::MsMs 365484 Specdb::MsMs 2818539 Specdb::MsMs 2818540 Specdb::MsMs 2818541 Specdb::MsMs 2889868 Specdb::MsMs 2889869 Specdb::MsMs 2889870 C14772 4446266 FDB022971 5283142 63974 BMDBP02908 Epoxide hydrolase 2, cytoplasmic Q17QK4 EPHX2 Enzyme