1.0 2018-08-27 17:29:46 UTC 2020-04-16 17:52:46 UTC BMDB0062588 BMDB62588 Lycopodic acid (e)-11-Hexadecenoic acid belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms (e)-11-Hexadecenoic acid is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. (e)-11-Hexadecenoate Lycopodate C16H30O2 254.4082 254.224580204 (11E)-hexadec-11-enoic acid (11E)-hexadec-11-enoic acid 73292-39-4 [H]\C(CCCC)=C(\[H])CCCCCCCCCC(O)=O InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h5-6H,2-4,7-15H2,1H3,(H,17,18)/b6-5+ JGMYDQCXGIMHLL-AATRIKPKSA-N belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acids and conjugates Long-chain fatty acids 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 Long-chain fatty acid Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Straight chain fatty acid Unsaturated fatty acid Aliphatic acyclic compounds Unsaturated fatty acids logp 6.71 ALOGPS logs -5.76 ALOGPS logp 5.89 ChemAxon pka_strongest_acidic 4.95 ChemAxon iupac (11E)-hexadec-11-enoic acid ChemAxon average_mass 254.4082 ChemAxon mono_mass 254.224580204 ChemAxon smiles [H]\C(CCCC)=C(\[H])CCCCCCCCCC(O)=O ChemAxon formula C16H30O2 ChemAxon inchi InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h5-6H,2-4,7-15H2,1H3,(H,17,18)/b6-5+ ChemAxon inchikey JGMYDQCXGIMHLL-AATRIKPKSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 78.2 ChemAxon polarizability 33.38 ChemAxon rotatable_bond_count 13 ChemAxon acceptor_count 2 ChemAxon donor_count 1 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 Specdb::CMs 15955 Specdb::CMs 45502 Specdb::CMs 134243 Specdb::CMs 141977 Specdb::MsMs 87750 Specdb::MsMs 87751 Specdb::MsMs 87752 Specdb::MsMs 150318 Specdb::MsMs 150319 Specdb::MsMs 150320 Specdb::MsMs 2319791 Specdb::MsMs 2319792 Specdb::MsMs 2319793 Specdb::MsMs 2618447 Specdb::MsMs 2618448 Specdb::MsMs 2618449 Milk Two pasteurized milk brands from the Middle Eastern Region of Paraná State By Gas Chromatography (n = 15) Julliana Isabelle Simionato, Juliana Carla Garcia, Geraldo Tadeu dos Santos, Cláudio Celestino Oliveira, Jesui Vergilio Visentainera and Nilson Evelázio de Souza. Validation of the Determination of Fatty Acids in Milk by Gas Chromatography. J. Braz. Chem. Soc., Vol. 21, No. 3, 520-524, 2010. Muscle Samples have been collected from Heifer cows. Osorio MT, Downey G, Moloney AP, Rohrle FT, Luciano G, Schmidt O, Monahan FJ: Beef authentication using dietary markers: chemometric selection and modelling of significant beef biomarkers using concatenated data from multiple analytical methods. Food Chem. 2013 Dec 1;141(3):2795-801. doi: 10.1016/j.foodchem.2013.05.118. Epub 2013 Jun 5. 23871026 5312413 FDB016763 4471838 C00052540 Julliana Isabelle Simionato, Juliana Carla Garcia, Geraldo Tadeu dos Santos, Cláudio Celestino Oliveira, Jesui Vergilio Visentainera and Nilson Evelázio de Souza. Validation of the Determination of Fatty Acids in Milk by Gas Chromatography. J. Braz. Chem. Soc., Vol. 21, No. 3, 520-524, 2010.