1.0 2010-04-08 22:05:34 UTC 2019-11-26 02:58:08 UTC FDB002913 alpha-Triticene Constituent of Triticum aestivum (wheat). alpha-Triticene is found in wheat and common wheat. 2-tetradecenal, 4-methylene-, (2e)- 4-Methylene-(2e)-2-tetradecenal a-Triticene C15H26O 222.3663 222.198365454 (2Z)-4-methylidenetetradec-2-enal (2Z)-4-methylidenetetradec-2-enal 85769-28-4 CCCCCCCCCCC(=C)\C=C/C=O InChI=1S/C15H26O/c1-3-4-5-6-7-8-9-10-12-15(2)13-11-14-16/h11,13-14H,2-10,12H2,1H3/b13-11- STNNDCBSPFQUIQ-QBFSEMIESA-N belongs to the class of organic compounds known as fatty aldehydes. These are long chain aldehydes with a chain of at least 12 carbon atoms. Fatty aldehydes Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty aldehydes Aliphatic acyclic compounds Aldehydes Enals Hydrocarbon derivatives Organic oxides Aldehyde Aliphatic acyclic compound Alpha,beta-unsaturated aldehyde Carbonyl group Enal Fatty aldehyde Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound logp 6.09 ALOGPS logs -6.07 ALOGPS solubility 1.91e-04 g/l ALOGPS logp 5.15 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac (2Z)-4-methylidenetetradec-2-enal ChemAxon average_mass 222.3663 ChemAxon mono_mass 222.198365454 ChemAxon smiles CCCCCCCCCCC(=C)\C=C/C=O ChemAxon formula C15H26O ChemAxon inchi InChI=1S/C15H26O/c1-3-4-5-6-7-8-9-10-12-15(2)13-11-14-16/h11,13-14H,2-10,12H2,1H3/b13-11- ChemAxon inchikey STNNDCBSPFQUIQ-QBFSEMIESA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 72.38 ChemAxon polarizability 29.02 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22768 Specdb::CMs 172899 Specdb::MsMs 109701 Specdb::MsMs 109702 Specdb::MsMs 109703 Specdb::MsMs 177201 Specdb::MsMs 177202 Specdb::MsMs 177203 Specdb::MsMs 2836518 Specdb::MsMs 2836519 Specdb::MsMs 2836520 Specdb::MsMs 2872235 Specdb::MsMs 2872236 Specdb::MsMs 2872237 HMDB30939 #<Reference:0x000055ce32c482d0> Common wheat Type 1 specific Triticum aestivum 4565 Wheat Type 1 specific Triticum 4564