1.0 2010-04-08 22:05:37 UTC 2019-11-26 02:58:19 UTC FDB003004 Catelaidic acid Constituent of partially hydrogenated fish oil. Catelaidic acid is found in fats and oils and fishes. Catelaidic acid C22H42O2 338.5677 338.318480588 (11E)-docos-11-enoic acid (E)-docos-11-enoic acid 62600-37-7 CCCCCCCCCC\C=C\CCCCCCCCCC(O)=O InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h11-12H,2-10,13-21H2,1H3,(H,23,24)/b12-11+ KJDZDTDNIULJBE-VAWYXSNFSA-N belongs to the class of organic compounds known as very long-chain fatty acids. These are fatty acids with an aliphatic tail that contains at least 22 carbon atoms. Very long-chain fatty acids Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Aliphatic acyclic compounds Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Straight chain fatty acids Unsaturated fatty acids Aliphatic acyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Straight chain fatty acid Unsaturated fatty acid Very long-chain fatty acid Unsaturated fatty acids logp 8.97 ALOGPS logs -7.17 ALOGPS solubility 2.28e-05 g/l ALOGPS logp 8.56 ChemAxon pka_strongest_acidic 4.95 ChemAxon iupac (11E)-docos-11-enoic acid ChemAxon average_mass 338.5677 ChemAxon mono_mass 338.318480588 ChemAxon smiles CCCCCCCCCC\C=C\CCCCCCCCCC(O)=O ChemAxon formula C22H42O2 ChemAxon inchi InChI=1S/C22H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h11-12H,2-10,13-21H2,1H3,(H,23,24)/b12-11+ ChemAxon inchikey KJDZDTDNIULJBE-VAWYXSNFSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 105.81 ChemAxon polarizability 46.22 ChemAxon rotatable_bond_count 19 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 19269 Specdb::CMs 42313 Specdb::CMs 161105 Specdb::MsMs 48732 Specdb::MsMs 48733 Specdb::MsMs 48734 Specdb::MsMs 130068 Specdb::MsMs 130069 Specdb::MsMs 130070 Specdb::MsMs 2433544 Specdb::MsMs 2433545 Specdb::MsMs 2433546 Specdb::MsMs 2505113 Specdb::MsMs 2505114 Specdb::MsMs 2505115 HMDB31013 #<Reference:0x000055ce31715d40> Fats and oils Unknown generic Fishes Unknown generic