1.0 2011-09-21 01:50:50 UTC 2015-07-21 06:59:38 UTC FDB029150 19-Hydroxydeoxycorticosterone 19-hydroxydeoxycorticosterone (19,21-dihydroxy-4-pregnen-3,20-dione), 19-oxo-deoxycorticosterone (21-hydroxy-4-pregnen-3,19,20-trione), and 19-oic-deoxycorticosterone (19-oic-21-hydroxy-4-pregnen-3,20-dione)are formed from precursor deoxycorticosterone by adrenal glands obtained from intact rats and from rats undergoing adrenal regeneration.rat adrenals have the enzymes required to convert deoxycorticosterone to 19-hydroxydeoxycorticosterone, 19-oxo-deoxycorticosterone, and 19-oic-deoxycorticosterone; however, rat adrenals do not convert deoxycorticosterone or any of the oxygenated metabolites to 19-nor-deoxycorticosterone (21-hydroxy-19-nor-4-pregnen-3,20-dione). It is possible, however, that 19-nor-deoxycorticosterone is formed at peripheral sites from the oxygenated deoxycorticosterone precursors [HMDB] 11-deoxy-19-hydroxycorticosterone 11-desoxy-19-hydroxycorticosterone 19-Hydroxy-11-deoxycorticosterone 19-Hydroxy-11-desoxycorticosterone 19,21-dihydroxy-4-pregnene-3,20-dione 19,21-dihydroxypregn-4-ene-3,20-dione C21H30O4 346.4605 346.214409448 (2S,14S,15S)-14-(2-hydroxyacetyl)-2-(hydroxymethyl)-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-5-one (2S,14S,15S)-14-(2-hydroxyacetyl)-2-(hydroxymethyl)-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-5-one 2394-23-2 C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34CO)C1CC[C@@H]2C(=O)CO InChI=1S/C21H30O4/c1-20-8-7-17-15(16(20)4-5-18(20)19(25)11-22)3-2-13-10-14(24)6-9-21(13,17)12-23/h10,15-18,22-23H,2-9,11-12H2,1H3/t15?,16?,17?,18-,20+,21-/m1/s1 LFISWQXWWGJHBL-RJPFGDFGSA-N belongs to the class of organic compounds known as 21-hydroxysteroids. These are steroids carrying a hydroxyl group at the 21-position of the steroid backbone. 21-hydroxysteroids Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Hydroxysteroids Aliphatic homopolycyclic compounds 20-oxosteroids 3-oxo delta-4-steroids Alpha-hydroxy ketones Cyclohexenones Delta-4-steroids Gluco/mineralocorticoids, progestogins and derivatives Hydrocarbon derivatives Organic oxides Primary alcohols 20-oxosteroid 21-hydroxysteroid 3-oxo-delta-4-steroid 3-oxosteroid Alcohol Aliphatic homopolycyclic compound Alpha-hydroxy ketone Carbonyl group Cyclic ketone Cyclohexenone Delta-4-steroid Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxosteroid Pregnane-skeleton Primary alcohol Progestogin-skeleton Solid logp 2.22 ALOGPS logs -4.15 ALOGPS solubility 2.47e-02 g/l ALOGPS logp 2.05 ChemAxon pka_strongest_acidic 13.86 ChemAxon pka_strongest_basic -0.97 ChemAxon iupac (2S,14S,15S)-14-(2-hydroxyacetyl)-2-(hydroxymethyl)-15-methyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-5-one ChemAxon average_mass 346.4605 ChemAxon mono_mass 346.214409448 ChemAxon smiles C[C@]12CCC3C(CCC4=CC(=O)CC[C@]34CO)C1CC[C@@H]2C(=O)CO ChemAxon formula C21H30O4 ChemAxon inchi InChI=1S/C21H30O4/c1-20-8-7-17-15(16(20)4-5-18(20)19(25)11-22)3-2-13-10-14(24)6-9-21(13,17)12-23/h10,15-18,22-23H,2-9,11-12H2,1H3/t15?,16?,17?,18-,20+,21-/m1/s1 ChemAxon inchikey LFISWQXWWGJHBL-RJPFGDFGSA-N ChemAxon polar_surface_area 74.6 ChemAxon refractivity 96.18 ChemAxon polarizability 38.96 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11080 Specdb::CMs 39974 Specdb::CMs 164325 Specdb::MsMs 290437 Specdb::MsMs 290438 Specdb::MsMs 290439 Specdb::MsMs 330109 Specdb::MsMs 330110 Specdb::MsMs 330111 Specdb::MsMs 3043045 Specdb::MsMs 3043046 Specdb::MsMs 3043047 Specdb::MsMs 3097924 Specdb::MsMs 3097925 Specdb::MsMs 3097926 HMDB12612