1.0 2016-09-30 23:19:48 UTC 2020-04-22 15:16:44 UTC BMDB0006035 BMDB06035 4-Dihydroboldenone (5beta,17beta)-17-Hydroxyandrost-1-en-3-one (5b,17b)-17-Hydroxyandrost-1-en-3-one (5Β,17β)-17-hydroxyandrost-1-en-3-one 17b-Hydroxy-5b -androst-1-en-3-one 17b-Hydroxy-5b-androst-1-en-3-one 5b-Androst-1-en-17b-ol-3-one 5b-Androst-1-ene-17b-ol-3-one 5beta-Androst-1-en-17beta-ol-3-one Androst-1-en-17-ol-3-one 17β-Hydroxy-5β-androst-1-en-3-one 17beta-Hydroxy-5beta-androst-1-en-3-one 4-Dihydroboldenone 5beta-Androst-1-ene-17beta-ol-3-one 5β-Androst-1-en-17β-ol-3-one 5β-Androst-1-ene-17β-ol-3-one C19H28O2 288.4244 288.20893014 (1S,2R,7R,10R,11S,14S,15S)-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-3-en-5-one (1S,2R,7R,10R,11S,14S,15S)-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-3-en-5-one 10529-96-1 [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])CC(=O)C=C[C@]12C InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12-,14+,15+,16+,17+,18+,19+/m1/s1 OKJCFMUGMSVJBG-MISPCMORSA-N belongs to the class of organic compounds known as androgens and derivatives. These are 3-hydroxylated C19 steroid hormones. They are known to favor the development of masculine characteristics. They also show profound effects on scalp and body hair in humans. Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Androstane steroids Androgens and derivatives 17-hydroxysteroids 3-oxo delta-1-steroids 3-oxo-5-beta-steroids Cyclic alcohols and derivatives Cyclohexenones Delta-1-steroids Hydrocarbon derivatives Organic oxides Secondary alcohols 17-hydroxysteroid 3-oxo-5-beta-steroid 3-oxo-delta-1-steroid 3-oxosteroid Alcohol Aliphatic homopolycyclic compound Androgen-skeleton Carbonyl group Cyclic alcohol Cyclic ketone Cyclohexenone Delta-1-steroid Hydrocarbon derivative Hydroxysteroid Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxosteroid Secondary alcohol Aliphatic homopolycyclic compounds 17beta-hydroxy steroid 3-oxo Delta(1)-steroid Solid logp 3.38 ALOGPS logs -4.35 ALOGPS logp 3.41 ChemAxon pka_strongest_acidic 19.38 ChemAxon pka_strongest_basic -0.88 ChemAxon iupac (1S,2R,7R,10R,11S,14S,15S)-14-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-3-en-5-one ChemAxon average_mass 288.4244 ChemAxon mono_mass 288.20893014 ChemAxon smiles [H][C@@]12CC[C@H](O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@]2([H])CC(=O)C=C[C@]12C ChemAxon formula C19H28O2 ChemAxon inchi InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-17,21H,3-6,8,10-11H2,1-2H3/t12-,14+,15+,16+,17+,18+,19+/m1/s1 ChemAxon inchikey OKJCFMUGMSVJBG-MISPCMORSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 84.7 ChemAxon polarizability 33.61 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 4 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::CMs 10184 Specdb::CMs 38943 Specdb::CMs 137273 Specdb::CMs 145007 Specdb::MsMs 288475 Specdb::MsMs 288476 Specdb::MsMs 288477 Specdb::MsMs 327604 Specdb::MsMs 327605 Specdb::MsMs 327606 Specdb::MsMs 2379369 Specdb::MsMs 2379370 Specdb::MsMs 2379371 Specdb::MsMs 2556888 Specdb::MsMs 2556889 Specdb::MsMs 2556890 FDB023811 20045328 12133279 87331