2.0 2015-06-05 20:46:57 -0600 2015-08-14 15:21:41 -0600 ECMDB24003 M2MDB005288 N,N-Dimethylglycine (dimethylamino)Acetate (dimethylamino)Acetic acid 2-(dimethylamino)Acetate 2-(dimethylamino)Acetic acid N,N-Dimethylaminoacetate N,N-Dimethylaminoacetic acid N,N-Dimethylglycine N-Methylsarcosine N,N-dimethyl-glycine C4H9NO2 103.1198 103.063328537 2-(dimethylamino)acetic acid dimethylglycine 1118-68-9 CN(C)CC(O)=O InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7) FFDGPVCHZBVARC-UHFFFAOYSA-N logp -1.70 ALOGPS logs 0.96 ALOGPS solubility 9.39e+02 g/l ALOGPS logp -3.1 ChemAxon pka_strongest_acidic 1.88 ChemAxon pka_strongest_basic 9.69 ChemAxon iupac 2-(dimethylamino)acetic acid ChemAxon average_mass 103.1198 ChemAxon mono_mass 103.063328537 ChemAxon smiles CN(C)CC(O)=O ChemAxon formula C4H9NO2 ChemAxon inchi InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7) ChemAxon inchikey FFDGPVCHZBVARC-UHFFFAOYSA-N ChemAxon polar_surface_area 40.54 ChemAxon refractivity 26.07 ChemAxon polarizability 10.47 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 3 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Quorum Sensing Bacterial Autoinducer 2 (AI-2) mediates the quorum sensing 2 system. AI-2 is catalyzed by the luxS enzyme. This enzyme is found in E.coli and S.typhimurium. In E. coli and most pathogenic bacteria that form AI-2 are spontaneous transformations that include cyclization to (2R,4S)-2-methyl-2,4-dihydroxydihydrofuran-3-one and hydration to the final autoinducer (2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran. This product is released from the cell through the AI-2 transporter (tqsA). As the level of AI-2 increases, other cells detect it and import it through the autoinducer-2 ABC transporter (lsrACDB). AI-2 is then degraded in the cells by phosphorylating the AI-2 which is then isomerized to P-HPD which follows by the transfer of and acetyl group to coenzyme A and releases dihydroxyacetone phosphate PW000836 Signaling S-adenosyl-L-methionine cycle The S-adenosyl-L-methionine cycle starts with S-adenosyl-L-methionine reacting with (a demethylated methyl donor ) dimethylglycine resulting in the release of a hydrogen ion, a betain (a methylated methyl donor) and a S-adenosyl-L-homocysteine. The s-adenosyl-L-homocysteine reacts with a water molecule through a S-adenosylhomocysteine nucleosidase resulting in the release of a adenine and a ribosyl-L-homocysteine. This compound in turn reacts with a s-ribosylhomocysteine lyase resulting in the release of a l-homocysteine and a autoinducer 2. The L-homocysteine reacts with a N5-methyl-tetrahydropteroyl tri-L-glutamate through a methionine synthase resulting in the release of a tetrahydropteroyl tri-L-glutamate and a methione. The methionine in turn reacts with a water molecule and ATP molecule through a methionine adenosyltransferase resulting in the release of a diphosphate, a phosphate and a s-adenosyl-L-methionine. PW002080 Metabolic Specdb::CMs 891 Specdb::CMs 8607 Specdb::CMs 30993 Specdb::CMs 37289 Specdb::CMs 148193 Specdb::CMs 1049871 Specdb::NmrOneD 1079 Specdb::NmrOneD 1140 Specdb::NmrOneD 2157 Specdb::NmrOneD 2844 Specdb::NmrOneD 142130 Specdb::NmrOneD 142131 Specdb::NmrOneD 142132 Specdb::NmrOneD 142133 Specdb::NmrOneD 142134 Specdb::NmrOneD 142135 Specdb::NmrOneD 142136 Specdb::NmrOneD 142137 Specdb::NmrOneD 142138 Specdb::NmrOneD 142139 Specdb::NmrOneD 142140 Specdb::NmrOneD 142141 Specdb::NmrOneD 142142 Specdb::NmrOneD 142143 Specdb::NmrOneD 142144 Specdb::NmrOneD 142145 Specdb::NmrOneD 142146 Specdb::NmrOneD 142147 Specdb::NmrOneD 142148 Specdb::NmrOneD 142149 Specdb::NmrOneD 166481 Specdb::MsMs 141 Specdb::MsMs 142 Specdb::MsMs 143 Specdb::MsMs 2826 Specdb::MsMs 2827 Specdb::MsMs 2828 Specdb::MsMs 2829 Specdb::MsMs 2830 Specdb::MsMs 2831 Specdb::MsMs 2832 Specdb::MsMs 2833 Specdb::MsMs 2834 Specdb::MsMs 2835 Specdb::MsMs 260658 Specdb::MsMs 260659 Specdb::MsMs 260660 Specdb::MsMs 280593 Specdb::MsMs 280594 Specdb::MsMs 280595 Specdb::MsMs 439092 Specdb::MsMs 445980 Specdb::MsMs 445981 Specdb::MsMs 445982 Specdb::MsMs 445983 Specdb::MsMs 445984 Specdb::NmrTwoD 953 Specdb::NmrTwoD 1137 C01026