1.0 2010-04-08 22:06:08 UTC 2025-11-18 22:55:29 UTC FDB004206 Avenin Avenin, also known as prolamin protein, plant or prolamins, is a member of the class of compounds known as phosphate esters. Phosphate esters are organic compounds containing phosphoric acid ester functional group, with the general structure R1P(=O)(R2)OR3. R1,R2 = O,N, or halogen atom; R3 = organyl group. Avenin is soluble (in water) and a moderately acidic compound (based on its pKa). Avenin can be found in oat, which makes avenin a potential biomarker for the consumption of this food product. The oat (Avena sativa), sometimes called the common oat, is a species of cereal grain grown for its seed, which is known by the same name (usually in the plural, unlike other cereals and pseudocereals). While oats are suitable for human consumption as oatmeal and rolled oats, one of the most common uses is as livestock feed. Oats are a nutrient-rich food associated with lower blood cholesterol when consumed regularly . 1-Methylethyl (dimethoxyphosphinyl)carbamate Avenin (pesticide) Carbamic acid, (dimethoxyphosphinyl)-, 1-methylethyl ester Carbamic acid, phosphono-, c-isopropyl dimethyl ester Carbamic acid, phosphono-, C-isopropyl dimethyl ester (8CI) Carbamic acid, phosphono-, c-isopropyl p,p-dimethyl ester Carbamic acid, phosphono-, isopropyl dimethyl ester Carbamic acid, phosphono-, isopropyl dimethyl ester (6CI) Phosphonocarbamic acid c-isopropyl dimethyl ester C6H14NO5P 211.1528 211.060959075 propan-2-yl N-(dimethoxyphosphoryl)carbamate isopropyl N-(dimethoxyphosphoryl)carbamate COP(=O)(NC(=O)OC(C)C)OC InChI=1S/C6H14NO5P/c1-5(2)12-6(8)7-13(9,10-3)11-4/h5H,1-4H3,(H,7,8,9) XXRYFVCIMARHRS-UHFFFAOYSA-N belongs to the class of organic compounds known as phosphate esters. These are organic compounds containing phosphoric acid ester functional group, with the general structure R1P(=O)(R2)OR3. R1,R2 = O,N, or halogen atom; R3 = organyl group. Phosphate esters Organic compounds Organic acids and derivatives Organic phosphoric acids and derivatives Phosphate esters Aliphatic acyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic carbonic acids and derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds Aliphatic acyclic compound Carbonic acid derivative Carbonyl group Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Phosphoric acid ester logp -0.35 ALOGPS logs -0.98 ALOGPS solubility 2.20e+01 g/l ALOGPS logp 0.54 ChemAxon pka_strongest_acidic 2.71 ChemAxon iupac propan-2-yl N-(dimethoxyphosphoryl)carbamate ChemAxon average_mass 211.1528 ChemAxon mono_mass 211.060959075 ChemAxon smiles COP(=O)(NC(=O)OC(C)C)OC ChemAxon formula C6H14NO5P ChemAxon inchi InChI=1S/C6H14NO5P/c1-5(2)12-6(8)7-13(9,10-3)11-4/h5H,1-4H3,(H,7,8,9) ChemAxon inchikey XXRYFVCIMARHRS-UHFFFAOYSA-N ChemAxon polar_surface_area 73.86 ChemAxon refractivity 45.51 ChemAxon polarizability 19.07 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 105010 Specdb::CMs 117051 Specdb::MsMs 79446 Specdb::MsMs 79447 Specdb::MsMs 79448 Specdb::MsMs 140055 Specdb::MsMs 140056 Specdb::MsMs 140057 Specdb::MsMs 3417212 Specdb::MsMs 3417213 Specdb::MsMs 3417214 Specdb::MsMs 3417215 Specdb::MsMs 3417216 Specdb::MsMs 3417217 Specdb::NmrOneD 211947 Specdb::NmrOneD 211948 Specdb::NmrOneD 211949 Specdb::NmrOneD 211950 Specdb::NmrOneD 211951 Specdb::NmrOneD 211952 Specdb::NmrOneD 211953 Specdb::NmrOneD 211954 Specdb::NmrOneD 211955 Specdb::NmrOneD 211956 Specdb::NmrOneD 211957 Specdb::NmrOneD 211958 Specdb::NmrOneD 211959 Specdb::NmrOneD 211960 Specdb::NmrOneD 211961 Specdb::NmrOneD 211962 Specdb::NmrOneD 211963 Specdb::NmrOneD 211964 Specdb::NmrOneD 211965 Specdb::NmrOneD 211966 Oat Type 1 specific Avena sativa 4498 Neuromyostimulant 1155