1.0 2016-06-03 11:03:48 UTC 2026-08-21 22:25:13 UTC clobetasone SmallMolecule Clobetasone is an organic compound with the formula C22H26ClFO4 and an average molecular weight of 408.89 g/mol. It clobetasone belongs to the pregnane steroids, a subclass of steroids and steroid derivatives within the organic compounds. This compound is found in or released from three recorded sources, including corticosteroids, antiinflammatory agents, and antiinflammatory agents and antiinfectives in combination, all of which are categorized under healthcare, pharmaceuticals & veterinary products. The recorded exposure route for clobetasone is topical. Regarding its biological activity, clobetasone acts as an agonist of the glucocorticoid receptor (NR3C1), which is its sole recorded protein target. C22H26ClFO4 408.89 408.1503652 (1R,2S,10S,11S,13S,14R,15S)-14-(2-chloroacetyl)-1-fluoro-14-hydroxy-2,13,15-trimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-diene-5,17-dione (1R,2S,10S,11S,13S,14R,15S)-14-(2-chloroacetyl)-1-fluoro-14-hydroxy-2,13,15-trimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-diene-5,17-dione 54063-32-0 [H][C@]1(C)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@]2(C)[C@@]1(O)C(=O)CCl InChI=1S/C22H26ClFO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-16,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,19-,20-,21-,22-/m0/s1 XXIFVOHLGBURIG-OZCCCYNHSA-N Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Pregnane steroids Gluco/mineralocorticoids, progestogins and derivatives 11-oxosteroids 17-hydroxysteroids 20-oxosteroids 3-oxo delta-1,4-steroids Alkyl chlorides Alkyl fluorides Alpha-chloroketones Alpha-hydroxy ketones Cyclic alcohols and derivatives Cyclic ketones Delta-1,4-steroids Halogenated steroids Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Tertiary alcohols 11-oxosteroid 17-hydroxysteroid 20-oxosteroid 3-oxo-delta-1,4-steroid 3-oxosteroid 9-halo-steroid Alcohol Aliphatic homopolycyclic compound Alkyl chloride Alkyl fluoride Alkyl halide Alpha-chloroketone Alpha-haloketone Alpha-hydroxy ketone Carbonyl group Cyclic alcohol Cyclic ketone Delta-1,4-steroid Halo-steroid Hydrocarbon derivative Hydroxysteroid Ketone Organic oxide Organic oxygen compound Organochloride Organofluoride Organohalogen compound Organooxygen compound Oxosteroid Progestogin-skeleton Tertiary alcohol Aliphatic homopolycyclic compounds Detected and Not Quantified Clobetasone Action Pathway SMP0126192 Clobetasone Drug Metabolism Action Pathway SMP0144929 logp 3.6 logp 2.88 ALOGPS logs -4.77 ALOGPS solubility 6.91e-03 g/l ALOGPS logp 3.6 ChemAxon pka_strongest_acidic 12.49 ChemAxon pka_strongest_basic -3.9 ChemAxon iupac (1R,2S,10S,11S,13S,14R,15S)-14-(2-chloroacetyl)-1-fluoro-14-hydroxy-2,13,15-trimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-3,6-diene-5,17-dione ChemAxon average_mass 408.89 ChemAxon mono_mass 408.1503652 ChemAxon smiles [H][C@]1(C)C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)C(=O)C[C@]2(C)[C@@]1(O)C(=O)CCl ChemAxon formula C22H26ClFO4 ChemAxon inchi InChI=1S/C22H26ClFO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-16,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,19-,20-,21-,22-/m0/s1 ChemAxon inchikey XXIFVOHLGBURIG-OZCCCYNHSA-N ChemAxon polar_surface_area 71.44 ChemAxon refractivity 104.72 ChemAxon polarizability 41.36 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722204c770> DB13158 71387 64482 BE0000794