1.0 2016-05-22 05:29:12 UTC 2026-08-22 03:52:26 UTC Eplerenone SmallMolecule Eplerenone is an organic compound with the formula C24H30O6 and an average molecular weight of 414.49 g/mol. Eplerenone belongs to the steroid lactones, a subclass of steroids and steroid derivatives within the organic compounds. It acts as an antagonist of the mineralocorticoid receptor (NR3C2). This compound is found in or released from four recorded sources, including diuretics within healthcare, pharmaceuticals, and veterinary products, line transmission systems in electrical and electronic equipment, and other smoking requisites and non-electric simulated smoking devices in household cleaning and consumer products. The recorded exposure route for eplerenone is oral. C24H30O6 414.4914 414.204238692 methyl (1'R,2R,2'S,9'R,10'R,11'S,15'S,17'R)-2',15'-dimethyl-5,5'-dioxo-18'-oxaspiro[oxolane-2,14'-pentacyclo[8.8.0.0¹,¹⁷.0²,⁷.0¹¹,¹⁵]octadecan]-6'-ene-9'-carboxylate eplerenone 107724-20-9 [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)C[C@H]1O[C@@]11[C@@]2([H])[C@@H](CC2=CC(=O)CC[C@]12C)C(=O)OC InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3/t15-,16+,17-,19+,21+,22+,23-,24-/m1/s1 JUKPWJGBANNWMW-VWBFHTRKSA-N Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Steroid lactones Spironolactones and derivatives Cyclohexenones Dialkyl ethers Dicarboxylic acids and derivatives Epoxides Gamma butyrolactones Hydrocarbon derivatives Methyl esters Organic oxides Oxacyclic compounds Oxepanes Tetrahydrofurans Aliphatic heteropolycyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cyclic ketone Cyclohexenone Dialkyl ether Dicarboxylic acid or derivatives Ether Gamma butyrolactone Hydrocarbon derivative Ketone Lactone Methyl ester Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxepane Oxirane Spironolactone Tetrahydrofuran Aliphatic heteropolycyclic compounds 3-oxo steroid epoxide gamma-lactone methyl ester oxaspiro compound steroid acid ester Detected and Not Quantified Eplerenone Action Pathway (Old) SMP0000135 Eplerenone Action Pathway SMP0122731 Eplerenone Drug Metabolism Action Pathway SMP0143144 logp 2.33 logp 1.67 ALOGPS logs -4.66 ALOGPS solubility 9.03e-03 g/l ALOGPS logp 2.33 ChemAxon pka_strongest_acidic 15.11 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac methyl (1'R,2R,2'S,9'R,10'R,11'S,15'S,17'R)-2',15'-dimethyl-5,5'-dioxo-18'-oxaspiro[oxolane-2,14'-pentacyclo[8.8.0.0¹,¹⁷.0²,⁷.0¹¹,¹⁵]octadecan]-6'-ene-9'-carboxylate ChemAxon average_mass 414.4914 ChemAxon mono_mass 414.204238692 ChemAxon smiles [H][C@@]12CC[C@@]3(CCC(=O)O3)[C@@]1(C)C[C@H]1O[C@@]11[C@@]2([H])[C@@H](CC2=CC(=O)CC[C@]12C)C(=O)OC ChemAxon formula C24H30O6 ChemAxon inchi InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3/t15-,16+,17-,19+,21+,22+,23-,24-/m1/s1 ChemAxon inchikey JUKPWJGBANNWMW-VWBFHTRKSA-N ChemAxon polar_surface_area 82.2 ChemAxon refractivity 106.68 ChemAxon polarizability 43.79 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f7227638ad0> DB00700 443872 10203511 BE0000668