1.0 2010-04-08 22:14:10 UTC 2025-11-19 02:17:20 UTC FDB019152 4-Hydroxy-16,18-tritriacontanedione Constituent of the leaf waxes of Eucalyptus globulus (Tasmanian blue gum) C33H64O3 508.8595 508.485545914 4-hydroxytritriacontane-16,18-dione 4-hydroxytritriacontane-16,18-dione 97191-41-8 CCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCCCC(O)CCC InChI=1S/C33H64O3/c1-3-5-6-7-8-9-10-11-12-14-18-21-24-28-32(35)30-33(36)29-25-22-19-16-13-15-17-20-23-27-31(34)26-4-2/h31,34H,3-30H2,1-2H3 IUABXSHIXYIRMH-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms. Fatty alcohols Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty alcohols Aliphatic acyclic compounds Beta-diketones Hydrocarbon derivatives Ketones Organic oxides Secondary alcohols 1,3-dicarbonyl compound 1,3-diketone Alcohol Aliphatic acyclic compound Carbonyl group Fatty alcohol Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Secondary alcohol logp 9.69 ALOGPS logs -7.31 ALOGPS solubility 2.49e-05 g/l ALOGPS logp 11.9 ChemAxon pka_strongest_acidic 7.81 ChemAxon pka_strongest_basic -1.3 ChemAxon iupac 4-hydroxytritriacontane-16,18-dione ChemAxon average_mass 508.8595 ChemAxon mono_mass 508.485545914 ChemAxon smiles CCCCCCCCCCCCCCCC(=O)CC(=O)CCCCCCCCCCCC(O)CCC ChemAxon formula C33H64O3 ChemAxon inchi InChI=1S/C33H64O3/c1-3-5-6-7-8-9-10-11-12-14-18-21-24-28-32(35)30-33(36)29-25-22-19-16-13-15-17-20-23-27-31(34)26-4-2/h31,34H,3-30H2,1-2H3 ChemAxon inchikey IUABXSHIXYIRMH-UHFFFAOYSA-N ChemAxon polar_surface_area 54.37 ChemAxon refractivity 156.64 ChemAxon polarizability 69.97 ChemAxon rotatable_bond_count 30 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 21795 Specdb::CMs 46452 Specdb::MsMs 7193 Specdb::MsMs 7194 Specdb::MsMs 7195 Specdb::MsMs 13865 Specdb::MsMs 13866 Specdb::MsMs 13867 Specdb::MsMs 3038300 Specdb::MsMs 3038301 Specdb::MsMs 3038302 Specdb::MsMs 3105962 Specdb::MsMs 3105963 Specdb::MsMs 3105964 HMDB39536 #<Reference:0x000055ce302757a0>