1.0 2010-04-08 22:07:27 UTC 2025-11-18 23:03:53 UTC FDB007107 Eicosyl ferulate Eicosyl ferulate, also known as eicosyl ferulic acid, belongs to coumaric acids and derivatives class of compounds. Those are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Eicosyl ferulate is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Eicosyl ferulate can be found in potato, which makes eicosyl ferulate a potential biomarker for the consumption of this food product. C30H50O4 474.726 474.37091009 icosyl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate icosyl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate [H]\C(=C(/[H])C1=CC(OC)=C(O)C=C1)C(=O)OCCCCCCCCCCCCCCCCCCCC InChI=1S/C30H50O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-34-30(32)24-22-27-21-23-28(31)29(26-27)33-2/h21-24,26,31H,3-20,25H2,1-2H3/b24-22- UBNJQWYYWIBSGN-GYHWCHFESA-N belongs to the class of organic compounds known as coumaric acids and derivatives. These are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Coumaric acids and derivatives Organic compounds Phenylpropanoids and polyketides Cinnamic acids and derivatives Hydroxycinnamic acids and derivatives Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Carbonyl compounds Cinnamic acid esters Enoate esters Fatty acid esters Fatty alcohol esters Hydrocarbon derivatives Methoxybenzenes Methoxyphenols Monocarboxylic acids and derivatives Organic oxides Phenoxy compounds Styrenes 1-hydroxy-2-unsubstituted benzenoid Alkyl aryl ether Alpha,beta-unsaturated carboxylic ester Anisole Aromatic homomonocyclic compound Benzenoid Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cinnamic acid ester Coumaric acid or derivatives Enoate ester Ether Fatty acid ester Fatty acyl Fatty alcohol ester Hydrocarbon derivative Methoxybenzene Methoxyphenol Monocarboxylic acid or derivatives Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenol Phenol ether Phenoxy compound Styrene logp 9.70 ALOGPS logs -7.18 ALOGPS solubility 3.12e-05 g/l ALOGPS logp 10.49 ChemAxon pka_strongest_acidic 9.87 ChemAxon pka_strongest_basic -4.9 ChemAxon iupac icosyl (2Z)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate ChemAxon average_mass 474.726 ChemAxon mono_mass 474.37091009 ChemAxon smiles [H]\C(=C(/[H])C1=CC(OC)=C(O)C=C1)C(=O)OCCCCCCCCCCCCCCCCCCCC ChemAxon formula C30H50O4 ChemAxon inchi InChI=1S/C30H50O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-34-30(32)24-22-27-21-23-28(31)29(26-27)33-2/h21-24,26,31H,3-20,25H2,1-2H3/b24-22- ChemAxon inchikey UBNJQWYYWIBSGN-GYHWCHFESA-N ChemAxon polar_surface_area 55.76 ChemAxon refractivity 143.76 ChemAxon polarizability 61.52 ChemAxon rotatable_bond_count 23 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 78483 Specdb::MsMs 78484 Specdb::MsMs 78485 Specdb::MsMs 138837 Specdb::MsMs 138838 Specdb::MsMs 138839 Specdb::MsMs 3603656 Specdb::MsMs 3603657 Specdb::MsMs 3603658 Specdb::MsMs 3603659 Specdb::MsMs 3603660 Specdb::MsMs 3603661 Potato Type 1 specific Solanum tuberosum 4113