1.0 2010-04-08 22:09:33 UTC 2025-11-18 23:25:56 UTC FDB011279 Myricolal Constituent of Myrica gale (bog myrtle). Myricolal is found in herbs and spices. Myricolal C30H48O2 440.7009 440.36543078 10-hydroxy-2,2,6b,9,9,12a,14a-heptamethyl-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-icosahydropicene-4a-carbaldehyde 10-hydroxy-2,2,6b,9,9,12a,14a-heptamethyl-1,3,4,5,7,8,8a,10,11,12,12b,13,14,14b-tetradecahydropicene-4a-carbaldehyde CC1(C)CCC2(CC=C3C4(C)CCC5C(C)(C)C(O)CCC5(C)C4CCC3(C)C2C1)C=O InChI=1S/C30H48O2/c1-25(2)16-17-30(19-31)15-10-22-28(6)12-8-20-26(3,4)24(32)11-14-27(20,5)21(28)9-13-29(22,7)23(30)18-25/h10,19-21,23-24,32H,8-9,11-18H2,1-7H3 IFVLEXPVJXHCAY-UHFFFAOYSA-N belongs to the class of organic compounds known as scalarane sesterterpenoids. These are sesterterpenoids with a structure based on the scalarane backbone. Scalarane is a tetracyclic compound, which is similar the homoandrostane with five methyl groups at the 4-, 4-, 8-, 17-, 17a-positions. Scalarane sesterterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesterterpenoids Aliphatic homopolycyclic compounds Aldehydes Cyclic alcohols and derivatives Hydrocarbon derivatives Organic oxides Secondary alcohols Alcohol Aldehyde Aliphatic homopolycyclic compound Carbonyl group Cyclic alcohol Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Scalarane sesterterpenoid Secondary alcohol logp 6.36 ALOGPS logs -6.49 ALOGPS solubility 1.44e-04 g/l ALOGPS melting_point Mp 288° logp 6.44 ChemAxon pka_strongest_acidic 19.49 ChemAxon pka_strongest_basic -0.84 ChemAxon iupac 10-hydroxy-2,2,6b,9,9,12a,14a-heptamethyl-1,2,3,4,4a,5,6b,7,8,8a,9,10,11,12,12a,12b,13,14,14a,14b-icosahydropicene-4a-carbaldehyde ChemAxon average_mass 440.7009 ChemAxon mono_mass 440.36543078 ChemAxon smiles CC1(C)CCC2(CC=C3C4(C)CCC5C(C)(C)C(O)CCC5(C)C4CCC3(C)C2C1)C=O ChemAxon formula C30H48O2 ChemAxon inchi InChI=1S/C30H48O2/c1-25(2)16-17-30(19-31)15-10-22-28(6)12-8-20-26(3,4)24(32)11-14-27(20,5)21(28)9-13-29(22,7)23(30)18-25/h10,19-21,23-24,32H,8-9,11-18H2,1-7H3 ChemAxon inchikey IFVLEXPVJXHCAY-UHFFFAOYSA-N ChemAxon polar_surface_area 37.3 ChemAxon refractivity 132.7 ChemAxon polarizability 54.22 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20018 Specdb::CMs 43177 Specdb::CMs 154601 Specdb::MsMs 9170 Specdb::MsMs 9171 Specdb::MsMs 9172 Specdb::MsMs 15842 Specdb::MsMs 15843 Specdb::MsMs 15844 Specdb::MsMs 2329545 Specdb::MsMs 2329546 Specdb::MsMs 2329547 Specdb::MsMs 2636443 Specdb::MsMs 2636444 Specdb::MsMs 2636445 HMDB33257 #<Reference:0x000055ce32bb51b0> Herbs and Spices Unknown generic