1.0 2010-04-08 22:13:39 UTC 2025-11-19 02:10:57 UTC FDB018343 7alpha-7-Hydroxy-8(14),15-isopimaradien-18-oic acid Constituent of Juniperus communis (juniper). 7alpha-7-Hydroxy-8(14),15-isopimaradien-18-oic acid is found in alcoholic beverages and fruits. C20H30O3 318.4504 318.219494826 7-ethenyl-9-hydroxy-1,4a,7-trimethyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-1-carboxylic acid 7-ethenyl-9-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid 23807-91-2 CC1(CCC2C(=C1)C(O)CC1C2(C)CCCC1(C)C(O)=O)C=C InChI=1S/C20H30O3/c1-5-18(2)10-7-14-13(12-18)15(21)11-16-19(14,3)8-6-9-20(16,4)17(22)23/h5,12,14-16,21H,1,6-11H2,2-4H3,(H,22,23) PLKOJNUQWAKPNC-UHFFFAOYSA-N belongs to the class of organic compounds known as diterpenoids. These are terpene compounds formed by four isoprene units. Diterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Diterpenoids Aliphatic homopolycyclic compounds Carbonyl compounds Carboxylic acids Cyclic alcohols and derivatives Hydrocarbon derivatives Hydrophenanthrenes Monocarboxylic acids and derivatives Organic oxides Secondary alcohols Alcohol Aliphatic homopolycyclic compound Carbonyl group Carboxylic acid Carboxylic acid derivative Cyclic alcohol Diterpenoid Hydrocarbon derivative Hydrophenanthrene Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Phenanthrene Pimarane diterpenoid Secondary alcohol logp 3.79 ALOGPS logs -4.32 ALOGPS solubility 1.52e-02 g/l ALOGPS logp 3.84 ChemAxon pka_strongest_acidic 4.67 ChemAxon pka_strongest_basic -1.1 ChemAxon iupac 7-ethenyl-9-hydroxy-1,4a,7-trimethyl-1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydrophenanthrene-1-carboxylic acid ChemAxon average_mass 318.4504 ChemAxon mono_mass 318.219494826 ChemAxon smiles CC1(CCC2C(=C1)C(O)CC1C2(C)CCCC1(C)C(O)=O)C=C ChemAxon formula C20H30O3 ChemAxon inchi InChI=1S/C20H30O3/c1-5-18(2)10-7-14-13(12-18)15(21)11-16-19(14,3)8-6-9-20(16,4)17(22)23/h5,12,14-16,21H,1,6-11H2,2-4H3,(H,22,23) ChemAxon inchikey PLKOJNUQWAKPNC-UHFFFAOYSA-N ChemAxon polar_surface_area 57.53 ChemAxon refractivity 91.85 ChemAxon polarizability 36.58 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13383 Specdb::CMs 44198 Specdb::CMs 133149 Specdb::CMs 140883 Specdb::MsMs 6965 Specdb::MsMs 6966 Specdb::MsMs 6967 Specdb::MsMs 10367 Specdb::MsMs 10368 Specdb::MsMs 10369 Specdb::MsMs 13637 Specdb::MsMs 13638 Specdb::MsMs 13639 Specdb::MsMs 17039 Specdb::MsMs 17040 Specdb::MsMs 17041 Specdb::MsMs 2390887 Specdb::MsMs 2390888 Specdb::MsMs 2390889 Specdb::MsMs 2574910 Specdb::MsMs 2574911 Specdb::MsMs 2574912 HMDB35116 #<Reference:0x000055ce305d4db0> Alcoholic beverages Unknown generic Fruits Unknown generic