1.0 2010-04-08 22:11:14 UTC 2019-11-26 03:09:55 UTC FDB014372 Solavetivone Stress metabolite from potato tubers (Solanum tuberosum). Solavetivone is found in alcoholic beverages and potato. (-)-solavetivone 2-Isopropenyl-6,10-dimethylspiro[4.5]dec-6-en-8-one Katahdinone Solavetivone C15H22O 218.3346 218.167065326 6,10-dimethyl-2-(prop-1-en-2-yl)spiro[4.5]dec-6-en-8-one 6,10-dimethyl-2-(prop-1-en-2-yl)spiro[4.5]dec-6-en-8-one 54878-25-0 CC1CC(=O)C=C(C)C11CCC(C1)C(C)=C InChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-13H,1,5-6,8-9H2,2-4H3 FGCUSSRGQNHZRW-UHFFFAOYSA-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 homopolycyclic compounds Cyclohexenones Hydrocarbon derivatives Organic oxides Aliphatic homopolycyclic compound Carbonyl group Cyclic ketone Cyclohexenone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Sesquiterpenoid a sesquiterpenoid logp 3.97 ALOGPS logs -3.95 ALOGPS solubility 2.44e-02 g/l ALOGPS logp 3.7 ChemAxon pka_strongest_basic -4.7 ChemAxon iupac 6,10-dimethyl-2-(prop-1-en-2-yl)spiro[4.5]dec-6-en-8-one ChemAxon average_mass 218.3346 ChemAxon mono_mass 218.167065326 ChemAxon smiles CC1CC(=O)C=C(C)C11CCC(C1)C(C)=C ChemAxon formula C15H22O ChemAxon inchi InChI=1S/C15H22O/c1-10(2)13-5-6-15(9-13)11(3)7-14(16)8-12(15)4/h7,12-13H,1,5-6,8-9H2,2-4H3 ChemAxon inchikey FGCUSSRGQNHZRW-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 68.07 ChemAxon polarizability 26.12 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20206 Specdb::CMs 133990 Specdb::CMs 141724 Specdb::MsMs 102615 Specdb::MsMs 102616 Specdb::MsMs 102617 Specdb::MsMs 168474 Specdb::MsMs 168475 Specdb::MsMs 168476 Specdb::MsMs 2302041 Specdb::MsMs 2302042 Specdb::MsMs 2302043 Specdb::MsMs 3064251 Specdb::MsMs 3064252 Specdb::MsMs 3064253 HMDB35657 #<Reference:0x000055ce31dc9c18> Alcoholic beverages Unknown generic Potato Type 1 specific Solanum tuberosum 4113 4.45 4.45 4.45 mg/100 g Fungicide 940 A substance used to destroy fungal pests. Pesticide 1210 Strictly, a substance intended to kill pests. In common usage, any substance used for controlling, preventing, or destroying animal, microbiological or plant pests. Phytoalexin 1223 A toxin made by a plant that acts against an organism attacking it.