1.0 2010-04-08 22:11:04 UTC 2019-11-26 03:09:29 UTC FDB014076 Arnidenediol Found in many plants, including Taraxacum officinale (dandelion) Arnidenediol Arnidiol C30H50O2 442.7168 442.381080844 4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-docosahydropicene-3,8-diol 4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-hexadecahydropicene-3,8-diol 6750-30-7 CC1C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(O)C2(C)CCC1=C InChI=1S/C30H50O2/c1-18-11-14-28(6)24(32)17-30(8)20(25(28)19(18)2)9-10-22-27(5)15-13-23(31)26(3,4)21(27)12-16-29(22,30)7/h19-25,31-32H,1,9-17H2,2-8H3 IOPDFSGGBHSXSV-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 12-hydroxysteroids Cyclic alcohols and derivatives Hydrocarbon derivatives Secondary alcohols 12-hydroxysteroid Alcohol Aliphatic homopolycyclic compound Cyclic alcohol Hydrocarbon derivative Hydroxysteroid Organic oxygen compound Organooxygen compound Secondary alcohol Steroid Triterpenoid logp 5.35 ALOGPS logs -6.04 ALOGPS solubility 4.08e-04 g/l ALOGPS melting_point Mp 257° logp 6.22 ChemAxon pka_strongest_acidic 19.49 ChemAxon pka_strongest_basic -0.22 ChemAxon iupac 4,4,6a,6b,8a,12,14b-heptamethyl-11-methylidene-docosahydropicene-3,8-diol ChemAxon average_mass 442.7168 ChemAxon mono_mass 442.381080844 ChemAxon smiles CC1C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC(O)C2(C)CCC1=C ChemAxon formula C30H50O2 ChemAxon inchi InChI=1S/C30H50O2/c1-18-11-14-28(6)24(32)17-30(8)20(25(28)19(18)2)9-10-22-27(5)15-13-23(31)26(3,4)21(27)12-16-29(22,30)7/h19-25,31-32H,1,9-17H2,2-8H3 ChemAxon inchikey IOPDFSGGBHSXSV-UHFFFAOYSA-N ChemAxon polar_surface_area 40.46 ChemAxon refractivity 132.42 ChemAxon polarizability 54.85 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 11251 Specdb::CMs 44375 Specdb::CMs 147251 Specdb::MsMs 8828 Specdb::MsMs 8829 Specdb::MsMs 8830 Specdb::MsMs 15500 Specdb::MsMs 15501 Specdb::MsMs 15502 Specdb::MsMs 2278130 Specdb::MsMs 2278131 Specdb::MsMs 2278132 Specdb::MsMs 3087226 Specdb::MsMs 3087227 Specdb::MsMs 3087228 HMDB35401 #<Reference:0x000055ce334516c0> 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 Dandelion Type 1 specific Taraxacum officinale 50225 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Robusta coffee Type 1 specific Coffea canephora 49390 Sunflower Type 1 specific Helianthus annuus 4232 Tea Type 1 specific Camellia sinensis 4442 Counterirritant 839