1.0 2010-04-08 22:11:21 UTC 2025-11-19 00:47:55 UTC FDB014573 7-Ethylrosmanol 7-ethylrosmanol is a member of the class of compounds known as diterpene lactones. Diterpene lactones are diterpenoids containing a lactone moiety. 7-ethylrosmanol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 7-ethylrosmanol can be found in common sage and rosemary, which makes 7-ethylrosmanol a potential biomarker for the consumption of these food products. 7-Ethoxyrosmanol 7-Ethylrosmanol D-Arginine, N2-(O-ethyl-L-tyrosyl)-, trans- Ethylrosmanol Ethyltyrosylarginine methyl ester H-TYR(et)-d-arg-ome Tedam C22H30O5 374.4706 374.20932407 8-ethoxy-3,4-dihydroxy-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[7.5.2.0¹,¹⁰.0²,⁷]hexadeca-2,4,6-trien-15-one 8-ethoxy-3,4-dihydroxy-5-isopropyl-11,11-dimethyl-16-oxatetracyclo[7.5.2.0¹,¹⁰.0²,⁷]hexadeca-2,4,6-trien-15-one 111200-01-2 CCOC1C2OC(=O)C3(CCCC(C)(C)C23)C2=C(O)C(O)=C(C=C12)C(C)C InChI=1S/C22H30O5/c1-6-26-17-13-10-12(11(2)3)15(23)16(24)14(13)22-9-7-8-21(4,5)19(22)18(17)27-20(22)25/h10-11,17-19,23-24H,6-9H2,1-5H3 HEUIVINVBVPWCU-UHFFFAOYSA-N belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety. Diterpene lactones Organic compounds Lipids and lipid-like molecules Prenol lipids Terpene lactones Aromatic heteropolycyclic compounds 1-hydroxy-4-unsubstituted benzenoids Benzoxepines Carbonyl compounds Carboxylic acid esters Dialkyl ethers Diterpenoids Gamma butyrolactones Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Phenanthrenes and derivatives Tetrahydrofurans Tetralins 1-hydroxy-4-unsubstituted benzenoid Aromatic heteropolycyclic compound Benzenoid Benzoxepine Carbonyl group Carboxylic acid derivative Carboxylic acid ester Dialkyl ether Diterpene lactone Diterpenoid Ether Gamma butyrolactone Hydrocarbon derivative Lactone Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenanthrene Tetrahydrofuran Tetralin logp 4.44 ALOGPS logs -4.02 ALOGPS solubility 3.60e-02 g/l ALOGPS logp 4.58 ChemAxon pka_strongest_acidic 9.18 ChemAxon pka_strongest_basic -4.2 ChemAxon iupac 8-ethoxy-3,4-dihydroxy-11,11-dimethyl-5-(propan-2-yl)-16-oxatetracyclo[7.5.2.0¹,¹⁰.0²,⁷]hexadeca-2,4,6-trien-15-one ChemAxon average_mass 374.4706 ChemAxon mono_mass 374.20932407 ChemAxon smiles CCOC1C2OC(=O)C3(CCCC(C)(C)C23)C2=C(O)C(O)=C(C=C12)C(C)C ChemAxon formula C22H30O5 ChemAxon inchi InChI=1S/C22H30O5/c1-6-26-17-13-10-12(11(2)3)15(23)16(24)14(13)22-9-7-8-21(4,5)19(22)18(17)27-20(22)25/h10-11,17-19,23-24H,6-9H2,1-5H3 ChemAxon inchikey HEUIVINVBVPWCU-UHFFFAOYSA-N ChemAxon polar_surface_area 75.99 ChemAxon refractivity 102.21 ChemAxon polarizability 41.03 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 2 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 110196 Specdb::MsMs 110197 Specdb::MsMs 110198 Specdb::MsMs 177816 Specdb::MsMs 177817 Specdb::MsMs 177818 Specdb::MsMs 3605701 Specdb::MsMs 3605702 Specdb::MsMs 3605703 Specdb::MsMs 3605704 Specdb::MsMs 3605705 Specdb::MsMs 3605706 Common sage Type 1 specific Salvia officinalis 38868 Rosemary Type 1 specific Rosmarinus officinalis 39367