1.0 2010-04-08 22:09:25 UTC 2019-11-26 03:04:28 UTC FDB011020 N-Dihydroferuloyltyramine Alkaloid from stems of cherimoya (Annona cherimola). N-Dihydroferuloyltyramine is found in fruits. N-Dihydroferuloyltyramine C18H21NO4 315.3636 315.147058165 3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]propanamide 3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]propanamide 184877-32-5 COC1=CC(CCC(=O)NCCC2=CC=C(O)C=C2)=CC=C1O InChI=1S/C18H21NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-4,6-8,12,20-21H,5,9-11H2,1H3,(H,19,22) XLIPDHTUSRZSKE-UHFFFAOYSA-N belongs to the class of organic compounds known as methoxyphenols. Methoxyphenols are compounds containing a methoxy group attached to the benzene ring of a phenol moiety. Methoxyphenols Organic compounds Benzenoids Phenols Methoxyphenols Aromatic homomonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Anisoles Carbonyl compounds Fatty amides Hydrocarbon derivatives Methoxybenzenes Organic oxides Organonitrogen compounds Organopnictogen compounds Phenoxy compounds Secondary carboxylic acid amides 1-hydroxy-2-unsubstituted benzenoid Alkyl aryl ether Anisole Aromatic homomonocyclic compound Carbonyl group Carboxamide group Carboxylic acid derivative Ether Fatty acyl Fatty amide Hydrocarbon derivative Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phenol ether Phenoxy compound Secondary carboxylic acid amide logp 2.27 ALOGPS logs -4.00 ALOGPS solubility 3.18e-02 g/l ALOGPS logp 2.72 ChemAxon pka_strongest_acidic 9.37 ChemAxon pka_strongest_basic -0.83 ChemAxon iupac 3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]propanamide ChemAxon average_mass 315.3636 ChemAxon mono_mass 315.147058165 ChemAxon smiles COC1=CC(CCC(=O)NCCC2=CC=C(O)C=C2)=CC=C1O ChemAxon formula C18H21NO4 ChemAxon inchi InChI=1S/C18H21NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-4,6-8,12,20-21H,5,9-11H2,1H3,(H,19,22) ChemAxon inchikey XLIPDHTUSRZSKE-UHFFFAOYSA-N ChemAxon polar_surface_area 78.79 ChemAxon refractivity 88.48 ChemAxon polarizability 34.52 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24701 Specdb::CMs 43065 Specdb::CMs 130698 Specdb::CMs 138432 Specdb::MsMs 73326 Specdb::MsMs 73327 Specdb::MsMs 73328 Specdb::MsMs 132483 Specdb::MsMs 132484 Specdb::MsMs 132485 Specdb::MsMs 2392645 Specdb::MsMs 2392646 Specdb::MsMs 2392647 Specdb::MsMs 2569910 Specdb::MsMs 2569911 Specdb::MsMs 2569912 HMDB33028 #<Reference:0x000055ce316f86c8> Fruits Unknown generic