1.0 2010-04-08 22:12:31 UTC 2025-11-19 01:48:18 UTC FDB016569 3'-Deoxyoleacein Constituent of Olea europaea (olive). 3'-Deoxyoleacein is found in fats and oils, herbs and spices, and fruits. 3'-Deoxyoleacein 4-HPEA-EDA C17H20O5 304.3377 304.13107375 2-(4-hydroxyphenyl)ethyl (4Z)-4-formyl-3-(2-oxoethyl)hex-4-enoate 2-(4-hydroxyphenyl)ethyl (4Z)-4-formyl-3-(2-oxoethyl)hex-4-enoate 289030-99-5 C\C=C(/C=O)C(CC=O)CC(=O)OCCC1=CC=C(O)C=C1 InChI=1S/C17H20O5/c1-2-14(12-19)15(7-9-18)11-17(21)22-10-8-13-3-5-16(20)6-4-13/h2-6,9,12,15,20H,7-8,10-11H2,1H3/b14-2+ VPOVFCBNUOUZGG-JLZUIIAYSA-N belongs to the class of organic compounds known as tyrosols and derivatives. Tyrosols and derivatives are compounds containing a hydroxyethyl group attached to the C4 carbon of a phenol group. Tyrosols and derivatives Organic compounds Benzenoids Phenols Tyrosols and derivatives Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alpha-hydrogen aldehydes Benzene and substituted derivatives Carboxylic acid esters Enals Fatty acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides 1-hydroxy-2-unsubstituted benzenoid Aldehyde Alpha,beta-unsaturated aldehyde Alpha-hydrogen aldehyde Aromatic homomonocyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Enal Fatty acid ester Fatty acyl Hydrocarbon derivative Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Tyrosol derivative logp 2.95 ALOGPS logs -4.29 ALOGPS solubility 1.56e-02 g/l ALOGPS logp 1.83 ChemAxon pka_strongest_acidic 9.5 ChemAxon pka_strongest_basic -4.4 ChemAxon iupac 2-(4-hydroxyphenyl)ethyl (4Z)-4-formyl-3-(2-oxoethyl)hex-4-enoate ChemAxon average_mass 304.3377 ChemAxon mono_mass 304.13107375 ChemAxon smiles C\C=C(/C=O)C(CC=O)CC(=O)OCCC1=CC=C(O)C=C1 ChemAxon formula C17H20O5 ChemAxon inchi InChI=1S/C17H20O5/c1-2-14(12-19)15(7-9-18)11-17(21)22-10-8-13-3-5-16(20)6-4-13/h2-6,9,12,15,20H,7-8,10-11H2,1H3/b14-2+ ChemAxon inchikey VPOVFCBNUOUZGG-JLZUIIAYSA-N ChemAxon polar_surface_area 80.67 ChemAxon refractivity 83.27 ChemAxon polarizability 32.26 ChemAxon rotatable_bond_count 10 ChemAxon acceptor_count 4 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20831 Specdb::CMs 45425 Specdb::CMs 155292 Specdb::MsMs 51156 Specdb::MsMs 51157 Specdb::MsMs 51158 Specdb::MsMs 148494 Specdb::MsMs 148495 Specdb::MsMs 148496 Specdb::MsMs 3055592 Specdb::MsMs 3055593 Specdb::MsMs 3055594 Specdb::MsMs 3111815 Specdb::MsMs 3111816 Specdb::MsMs 3111817 HMDB37494 #<Reference:0x000055ce328f7428> Fats and oils Unknown generic Fruits Unknown generic Herbs and Spices Unknown generic