1.0 2010-04-08 22:10:22 UTC 2019-11-26 03:07:40 UTC FDB012815 Pollinastanol Isolated from Smilax medica (Sarsaparilla). Pollinastanol is found in dandelion. 9,19-Cyclo-14-methylcholestan-3-ol Pollinasterol C28H48O 400.6801 400.370516158 12,16-dimethyl-15-(6-methylheptan-2-yl)pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-ol 12,16-dimethyl-15-(6-methylheptan-2-yl)pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-ol 1912-66-9 CC(C)CCCC(C)C1CCC2(C)C3CCC4CC(O)CCC44CC34CCC12C InChI=1S/C28H48O/c1-19(2)7-6-8-20(3)23-12-13-26(5)24-10-9-21-17-22(29)11-14-27(21)18-28(24,27)16-15-25(23,26)4/h19-24,29H,6-18H2,1-5H3 HXQRIQXPGMPSRW-UHFFFAOYSA-N belongs to the class of organic compounds known as 3-hydroxysteroids. These are steroids carrying a hydroxyl group at the 3-position of the steroid backbone. 3-hydroxysteroids Organic compounds Lipids and lipid-like molecules Steroids and steroid derivatives Hydroxysteroids Aliphatic homopolycyclic compounds Cyclic alcohols and derivatives Hydrocarbon derivatives Secondary alcohols 3-hydroxysteroid Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Hydrocarbon derivative Organic oxygen compound Organooxygen compound Secondary alcohol logp 6.67 ALOGPS logs -7.24 ALOGPS solubility 2.30e-05 g/l ALOGPS melting_point Mp 111-112° (95°) logp 7.21 ChemAxon pka_strongest_acidic 18.3 ChemAxon pka_strongest_basic -1.4 ChemAxon iupac 12,16-dimethyl-15-(6-methylheptan-2-yl)pentacyclo[9.7.0.0¹,³.0³,⁸.0¹²,¹⁶]octadecan-6-ol ChemAxon average_mass 400.6801 ChemAxon mono_mass 400.370516158 ChemAxon smiles CC(C)CCCC(C)C1CCC2(C)C3CCC4CC(O)CCC44CC34CCC12C ChemAxon formula C28H48O ChemAxon inchi InChI=1S/C28H48O/c1-19(2)7-6-8-20(3)23-12-13-26(5)24-10-9-21-17-22(29)11-14-27(21)18-28(24,27)16-15-25(23,26)4/h19-24,29H,6-18H2,1-5H3 ChemAxon inchikey HXQRIQXPGMPSRW-UHFFFAOYSA-N ChemAxon polar_surface_area 20.23 ChemAxon refractivity 122.31 ChemAxon polarizability 52.25 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 1 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16357 Specdb::CMs 43868 Specdb::CMs 155443 Specdb::MsMs 7706 Specdb::MsMs 7707 Specdb::MsMs 7708 Specdb::MsMs 14378 Specdb::MsMs 14379 Specdb::MsMs 14380 Specdb::MsMs 2781577 Specdb::MsMs 2781578 Specdb::MsMs 2781579 Specdb::MsMs 2926876 Specdb::MsMs 2926877 Specdb::MsMs 2926878 HMDB34418 #<Reference:0x00007f093c023450> Dandelion Type 1 specific Taraxacum officinale 50225