1.0 2010-04-08 22:11:21 UTC 2019-11-26 03:10:22 UTC FDB014579 gamma-Taraxasterone Constituent of dandelion root (Taraxacum officinale). gamma-Taraxasterone is found in many foods, some of which are beverages, coffee and coffee products, alcoholic beverages, and tea. 20-Taraxasten-3-one Pseudotaraxasterone y-Taraxasterone C30H48O 424.7015 424.370516158 4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,12,12a,12b,13,14,14a,14b-icosahydropicen-3-one 4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,4a,5,6,7,8,9,12,12a,12b,13,14,14a-tetradecahydropicen-3-one 16054-73-2 CC1C2C3CCC4C5(C)CCC(=O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)CC=C1C InChI=1S/C30H48O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h11,20-23,25H,9-10,12-18H2,1-8H3 CJRZLPSJKBMUPM-UHFFFAOYSA-N belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units. Triterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Triterpenoids Aliphatic homopolycyclic compounds Cyclic ketones Hydrocarbon derivatives Organic oxides Aliphatic homopolycyclic compound Carbonyl group Cyclic ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Triterpenoid logp 6.60 ALOGPS logs -7.14 ALOGPS solubility 3.09e-05 g/l ALOGPS melting_point Mp 174-175° logp 7.95 ChemAxon pka_strongest_acidic 19.96 ChemAxon pka_strongest_basic -7.5 ChemAxon iupac 4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,12,12a,12b,13,14,14a,14b-icosahydropicen-3-one ChemAxon average_mass 424.7015 ChemAxon mono_mass 424.370516158 ChemAxon smiles CC1C2C3CCC4C5(C)CCC(=O)C(C)(C)C5CCC4(C)C3(C)CCC2(C)CC=C1C ChemAxon formula C30H48O ChemAxon inchi InChI=1S/C30H48O/c1-19-11-14-27(5)17-18-29(7)21(25(27)20(19)2)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h11,20-23,25H,9-10,12-18H2,1-8H3 ChemAxon inchikey CJRZLPSJKBMUPM-UHFFFAOYSA-N ChemAxon polar_surface_area 17.07 ChemAxon refractivity 131.16 ChemAxon polarizability 53.34 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16591 Specdb::CMs 159781 Specdb::MsMs 65511 Specdb::MsMs 65512 Specdb::MsMs 65513 Specdb::MsMs 122922 Specdb::MsMs 122923 Specdb::MsMs 122924 Specdb::MsMs 2438449 Specdb::MsMs 2438450 Specdb::MsMs 2438451 Specdb::MsMs 2523330 Specdb::MsMs 2523331 Specdb::MsMs 2523332 HMDB35817 #<Reference:0x000055ce328a8a58> Alcoholic beverages Unknown generic Arabica coffee Type 1 specific Coffea arabica 13443 Beverages Unknown generic Black tea Type 1 Coffee and coffee products Unknown generic Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Robusta coffee Type 1 specific Coffea canephora 49390 Tea Type 1 specific Camellia sinensis 4442