1.0 2016-09-30 23:19:41 UTC 2020-04-22 15:16:41 UTC BMDB0006026 BMDB06026 Norbolethone 13-EHDPO 13-Ethyl-17-hydroxy-18,19-dinor-17-pregn-4-en-20-yn-3-one Norboletone (+/-)-13,17a-diethyl-17b-hydroxygon-4-en-3-one (+/-)-13-ethyl-17-hydroxy-18,19-dinor-17a-pregn-4-en-3-one (+/-)-13b,17a-diethyl-17b-hydroxygon-4-en-3-one (+/-)-17a-ethyl-18-homo-19-nortestosterone (17a)-(+/-)-13-ethyl-17-hydroxy-18,19-dinorpregn-4-en-3-one 13-Ethyl-17-hydroxy-18,19-dinor-17a-pregn-4-en-3-one DL-13,17a-Diethyl-17-hydroxygon-4-en-3-one DL-13,17a-Diethyl-17b-hydroxygon-4-en-3-one DL-17b-Hydroxy-13b,17a-diethylgon-4-en-3-one DL-Norbolethone Genabol Wy 3475 C21H32O2 316.4776 316.240230268 (1S,2R,10R,11S,14S,15S)-14,15-diethyl-14-hydroxytetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-5-one norbolethone 1235-15-0 [H][C@@]12CC[C@@](O)(CC)[C@@]1(CC)CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H] InChI=1S/C21H32O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h13,16-19,23H,3-12H2,1-2H3/t16-,17+,18+,19-,20-,21-/m0/s1 FTBJKONNNSKOLX-XUDSTZEESA-N belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety. Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Pregnane steroids Gluco/mineralocorticoids, progestogins and derivatives 17-hydroxysteroids 3-oxo delta-4-steroids Cyclic alcohols and derivatives Cyclohexenones Delta-4-steroids Hydrocarbon derivatives Organic oxides Tertiary alcohols 17-hydroxysteroid 3-oxo-delta-4-steroid 3-oxosteroid Alcohol Aliphatic homopolycyclic compound Carbonyl group Cyclic alcohol Cyclic ketone Cyclohexenone Delta-4-steroid Hydrocarbon derivative Hydroxysteroid Ketone Organic oxide Organic oxygen compound Organooxygen compound Oxosteroid Progestogin-skeleton Tertiary alcohol Aliphatic homopolycyclic compounds Solid logp 4.02 ALOGPS logs -4.51 ALOGPS logp 4.31 ChemAxon pka_strongest_acidic 19.28 ChemAxon pka_strongest_basic -0.13 ChemAxon iupac (1S,2R,10R,11S,14S,15S)-14,15-diethyl-14-hydroxytetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-5-one ChemAxon average_mass 316.4776 ChemAxon mono_mass 316.240230268 ChemAxon smiles [H][C@@]12CC[C@@](O)(CC)[C@@]1(CC)CC[C@]1([H])[C@@]3([H])CCC(=O)C=C3CC[C@@]21[H] ChemAxon formula C21H32O2 ChemAxon inchi InChI=1S/C21H32O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h13,16-19,23H,3-12H2,1-2H3/t16-,17+,18+,19-,20-,21-/m0/s1 ChemAxon inchikey FTBJKONNNSKOLX-XUDSTZEESA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 93.72 ChemAxon polarizability 38.16 ChemAxon rotatable_bond_count 2 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 14990 Specdb::CMs 38937 Specdb::CMs 158404 Specdb::MsMs 299212 Specdb::MsMs 299213 Specdb::MsMs 299214 Specdb::MsMs 341161 Specdb::MsMs 341162 Specdb::MsMs 341163 Specdb::MsMs 2312105 Specdb::MsMs 2312106 Specdb::MsMs 2312107 Specdb::MsMs 2651066 Specdb::MsMs 2651067 Specdb::MsMs 2651068 FDB023805 59638 66255 D05204 Norboletone