1.0 2010-04-08 22:10:28 UTC 2019-11-26 03:07:50 UTC FDB012994 (3E,7E)-4,8,12-Trimethyl-1,3,7,11-tridecatetraene Constituent of essential oil of Elettaria cardamomum (cardamom). (3E,7E)-4,8,12-Trimethyl-1,3,7,11-tridecatetraene is found in cardamom, herbs and spices, and garden tomato (variety). (3E,7E)-4,8,12-trimethyltrideca-1,3,7,11-tetraene 4,8,12-trimethyl-1,3,7,11-tridecatetraene 4,8,12-Trimethyl-1,3E,7E,11-tridecatetraene 4,8,12-trimethyltrideca-1,3,7,11-tetraene TMTT C16H26 218.3776 218.203450832 (3E,7Z)-4,8,12-trimethyltrideca-1,3,7,11-tetraene (3E,7Z)-4,8,12-trimethyltrideca-1,3,7,11-tetraene 62235-06-7 CC(C)=CCC\C(C)=C/CC\C(C)=C\C=C InChI=1S/C16H26/c1-6-9-15(4)12-8-13-16(5)11-7-10-14(2)3/h6,9-10,13H,1,7-8,11-12H2,2-5H3/b15-9+,16-13- CWLVBFJCJXHUCF-ZAYWLTRMSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic acyclic compounds Alkatetraenes Branched unsaturated hydrocarbons Unsaturated aliphatic hydrocarbons Acyclic olefin Aliphatic acyclic compound Alkatetraene Branched unsaturated hydrocarbon Farsesane sesquiterpenoid Hydrocarbon Olefin Sesquiterpenoid Unsaturated aliphatic hydrocarbon Unsaturated hydrocarbon logp 6.07 ALOGPS logs -4.81 ALOGPS solubility 3.36e-03 g/l ALOGPS logp 5.58 ChemAxon iupac (3E,7Z)-4,8,12-trimethyltrideca-1,3,7,11-tetraene ChemAxon average_mass 218.3776 ChemAxon mono_mass 218.203450832 ChemAxon smiles CC(C)=CCC\C(C)=C/CC\C(C)=C\C=C ChemAxon formula C16H26 ChemAxon inchi InChI=1S/C16H26/c1-6-9-15(4)12-8-13-16(5)11-7-10-14(2)3/h6,9-10,13H,1,7-8,11-12H2,2-5H3/b15-9+,16-13- ChemAxon inchikey CWLVBFJCJXHUCF-ZAYWLTRMSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 77.86 ChemAxon polarizability 28.38 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 103182 Specdb::MsMs 103183 Specdb::MsMs 103184 Specdb::MsMs 169152 Specdb::MsMs 169153 Specdb::MsMs 169154 Specdb::CMs 21838 HMDB34498 #<Reference:0x000055ce31807ca8> Cardamom Type 1 specific Elettaria cardamomum 105181 Garden tomato (var.) Type 1 specific Solanum lycopersicum var. lycopersicum 397755 Herbs and Spices Unknown generic