1.0 2010-04-08 22:11:20 UTC 2019-11-26 03:10:18 UTC FDB014544 beta-Costic acid Constituent of the root of costus (Saussurea lappa). beta-Costic acid is found in burdock and herbs and spices. 4(15),11(13)-Selinadien-12-oic acid b-Costic acid Costic acid Costus acid D-arabino-hexose, 2-deoxy-, Diethyl Dithioacetal C15H22O2 234.334 234.161979948 2-(4a-methyl-8-methylidene-decahydronaphthalen-2-yl)prop-2-enoic acid 2-(4a-methyl-8-methylidene-octahydronaphthalen-2-yl)prop-2-enoic acid 3650-43-9 CC12CCCC(=C)C1CC(CC2)C(=C)C(O)=O InChI=1S/C15H22O2/c1-10-5-4-7-15(3)8-6-12(9-13(10)15)11(2)14(16)17/h12-13H,1-2,4-9H2,3H3,(H,16,17) UJQGVDNQDFTTLZ-UHFFFAOYSA-N belongs to the class of organic compounds known as eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids. These are sesquiterpenoids with a structure based on the eudesmane skeleton. Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic homopolycyclic compounds Carbonyl compounds Carboxylic acids Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic homopolycyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoid Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp 3.78 ALOGPS logs -4.25 ALOGPS solubility 1.33e-02 g/l ALOGPS melting_point Mp 87-88° logp 3.77 ChemAxon pka_strongest_acidic 5.05 ChemAxon iupac 2-(4a-methyl-8-methylidene-decahydronaphthalen-2-yl)prop-2-enoic acid ChemAxon average_mass 234.334 ChemAxon mono_mass 234.161979948 ChemAxon smiles CC12CCCC(=C)C1CC(CC2)C(=C)C(O)=O ChemAxon formula C15H22O2 ChemAxon inchi InChI=1S/C15H22O2/c1-10-5-4-7-15(3)8-6-12(9-13(10)15)11(2)14(16)17/h12-13H,1-2,4-9H2,3H3,(H,16,17) ChemAxon inchikey UJQGVDNQDFTTLZ-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 68.1 ChemAxon polarizability 27.11 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25951 Specdb::CMs 44565 Specdb::CMs 134301 Specdb::CMs 142035 Specdb::MsMs 79230 Specdb::MsMs 79231 Specdb::MsMs 79232 Specdb::MsMs 139779 Specdb::MsMs 139780 Specdb::MsMs 139781 Specdb::MsMs 2699261 Specdb::MsMs 2699262 Specdb::MsMs 2699263 Specdb::MsMs 3005643 Specdb::MsMs 3005644 Specdb::MsMs 3005645 HMDB35794 #<Reference:0x000055ce333a2d50> Burdock Type 1 specific Arctium lappa 4217 Herbs and Spices Unknown generic Anti bacterial 145 A substance that kills or slows the growth of bacteria. 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.