1.0 2010-04-08 22:10:57 UTC 2019-11-26 03:09:11 UTC FDB013863 Ximenic acid Isolated from seed fat of Ximenia subspecies and fish oil lipids. Ximenic acid is found in fats and oils and fishes. Ximenic acid C26H50O2 394.674 394.381080844 (17E)-hexacos-17-enoic acid (17E)-hexacos-17-enoic acid 66274-43-9 CCCCCCCC\C=C\CCCCCCCCCCCCCCCC(O)=O InChI=1S/C26H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h9-10H,2-8,11-25H2,1H3,(H,27,28)/b10-9+ RQIDQEBURXNDKG-MDZDMXLPSA-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 9.82 ALOGPS logs -7.39 ALOGPS solubility 1.62e-05 g/l ALOGPS melting_point Mp 50.5-50.9° logp 10.34 ChemAxon pka_strongest_acidic 4.95 ChemAxon iupac (17E)-hexacos-17-enoic acid ChemAxon average_mass 394.674 ChemAxon mono_mass 394.381080844 ChemAxon smiles CCCCCCCC\C=C\CCCCCCCCCCCCCCCC(O)=O ChemAxon formula C26H50O2 ChemAxon inchi InChI=1S/C26H50O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28/h9-10H,2-8,11-25H2,1H3,(H,27,28)/b10-9+ ChemAxon inchikey RQIDQEBURXNDKG-MDZDMXLPSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 124.21 ChemAxon polarizability 54.72 ChemAxon rotatable_bond_count 23 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25595 Specdb::CMs 44257 Specdb::CMs 169401 Specdb::MsMs 95793 Specdb::MsMs 95794 Specdb::MsMs 95795 Specdb::MsMs 160131 Specdb::MsMs 160132 Specdb::MsMs 160133 Specdb::MsMs 2280307 Specdb::MsMs 2280308 Specdb::MsMs 2280309 Specdb::MsMs 3084442 Specdb::MsMs 3084443 Specdb::MsMs 3084444 HMDB35215 #<Reference:0x000055ce3239af70> Fats and oils Unknown generic Fishes Unknown generic