1.0 2010-04-08 22:05:39 UTC 2019-11-26 02:58:29 UTC FDB003110 2-Hydroxylinolenic acid Constituent of Thymus vulgaris (thyme) seed oil. 2-Hydroxylinolenic acid is found in herbs and spices. 2-Hydroxylinolenic acid C18H30O3 294.429 294.219494826 (9E,12Z,15Z)-2-hydroxyoctadeca-9,12,15-trienoic acid (9E,12Z,15Z)-2-hydroxyoctadeca-9,12,15-trienoic acid CC\C=C/C\C=C/C\C=C\CCCCCCC(O)C(O)=O InChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h3-4,6-7,9-10,17,19H,2,5,8,11-16H2,1H3,(H,20,21)/b4-3-,7-6-,10-9+ JQXGCBKGIBTCHY-FVCZIJCZSA-N belongs to the class of organic compounds known as lineolic acids and derivatives. These are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions. Lineolic acids and derivatives Organic compounds Lipids and lipid-like molecules Fatty Acyls Lineolic acids and derivatives Aliphatic acyclic compounds Alpha hydroxy acids and derivatives Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Hydroxy fatty acids Long-chain fatty acids Monocarboxylic acids and derivatives Monosaccharides Organic oxides Secondary alcohols Unsaturated fatty acids Alcohol Aliphatic acyclic compound Alpha-hydroxy acid Carbonyl group Carboxylic acid Carboxylic acid derivative Fatty acid Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Long-chain fatty acid Monocarboxylic acid or derivatives Monosaccharide Octadecanoid Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol Unsaturated fatty acid logp 5.55 ALOGPS logs -5.08 ALOGPS solubility 2.46e-03 g/l ALOGPS logp 5.19 ChemAxon pka_strongest_acidic 4.29 ChemAxon pka_strongest_basic -3.8 ChemAxon iupac (9E,12Z,15Z)-2-hydroxyoctadeca-9,12,15-trienoic acid ChemAxon average_mass 294.429 ChemAxon mono_mass 294.219494826 ChemAxon smiles CC\C=C/C\C=C/C\C=C\CCCCCCC(O)C(O)=O ChemAxon formula C18H30O3 ChemAxon inchi InChI=1S/C18H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h3-4,6-7,9-10,17,19H,2,5,8,11-16H2,1H3,(H,20,21)/b4-3-,7-6-,10-9+ ChemAxon inchikey JQXGCBKGIBTCHY-FVCZIJCZSA-N ChemAxon polar_surface_area 57.53 ChemAxon refractivity 91.13 ChemAxon polarizability 35.18 ChemAxon rotatable_bond_count 13 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13916 Specdb::CMs 42358 Specdb::CMs 137798 Specdb::CMs 145532 Specdb::MsMs 94269 Specdb::MsMs 94270 Specdb::MsMs 94271 Specdb::MsMs 158286 Specdb::MsMs 158287 Specdb::MsMs 158288 Specdb::MsMs 2750254 Specdb::MsMs 2750255 Specdb::MsMs 2750256 Specdb::MsMs 2929192 Specdb::MsMs 2929193 Specdb::MsMs 2929194 HMDB31103 #<Reference:0x000055ce31714b48> Herbs and Spices Unknown generic