1.0 2010-04-08 22:08:13 UTC 2018-05-28 23:19:16 UTC FDB008732 2,4,14-Eicosatrienoic acid isobutylamide Alkaloid from Piper retrofractum (Javanese long pepper). 2,4,14-Eicosatrienoic acid isobutylamide N-Isobutyl-2,4,14-eicosatrienamide C24H43NO 361.6043 361.334465003 (2E,4E,14Z)-N-(2-methylpropyl)icosa-2,4,14-trienamide (2E,4E,14Z)-N-(2-methylpropyl)icosa-2,4,14-trienamide 151391-70-7 CCCCC\C=C/CCCCCCCC\C=C\C=C\C(=O)NCC(C)C InChI=1S/C24H43NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(2)3/h8-9,18-21,23H,4-7,10-17,22H2,1-3H3,(H,25,26)/b9-8-,19-18+,21-20+ GQCWFFNZERNJJC-SEXMCKGYSA-N belongs to the class of organic compounds known as n-acyl amines. N-acyl amines are compounds containing a fatty acid moiety linked to an amine group through an ester linkage. N-acyl amines Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty amides Aliphatic acyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Secondary carboxylic acid amides Aliphatic acyclic compound Carbonyl group Carboxamide group Carboxylic acid derivative Hydrocarbon derivative N-acyl-amine Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Secondary carboxylic acid amide logp 8.22 ALOGPS logs -7.14 ALOGPS solubility 2.60e-05 g/l ALOGPS logp 7.97 ChemAxon pka_strongest_acidic 16.35 ChemAxon pka_strongest_basic 2.25 ChemAxon iupac (2E,4E,14Z)-N-(2-methylpropyl)icosa-2,4,14-trienamide ChemAxon average_mass 361.6043 ChemAxon mono_mass 361.334465003 ChemAxon smiles CCCCC\C=C/CCCCCCCC\C=C\C=C\C(=O)NCC(C)C ChemAxon formula C24H43NO ChemAxon inchi InChI=1S/C24H43NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(26)25-22-23(2)3/h8-9,18-21,23H,4-7,10-17,22H2,1-3H3,(H,25,26)/b9-8-,19-18+,21-20+ ChemAxon inchikey GQCWFFNZERNJJC-SEXMCKGYSA-N ChemAxon polar_surface_area 29.1 ChemAxon refractivity 119.28 ChemAxon polarizability 49.15 ChemAxon rotatable_bond_count 17 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 102543 Specdb::MsMs 102544 Specdb::MsMs 102545 Specdb::MsMs 168381 Specdb::MsMs 168382 Specdb::MsMs 168383 Specdb::MsMs 2345498 Specdb::MsMs 2345499 Specdb::MsMs 2345500 Specdb::MsMs 2590303 Specdb::MsMs 2590304 Specdb::MsMs 2590305 Specdb::CMs 14610 Specdb::CMs 133232 Specdb::CMs 140966 HMDB32032 #<Reference:0x000055ce307d56c8>