2.02012-05-31 14:27:19 -06002015-06-03 17:19:18 -0600ECMDB20097M2MDB0009455-(2-Hydroxyethyl)-4-methylthiazole5-(2-hydroxyethyl)-4-methylthiazole is a member of the chemical class known as Thiazoles. These are heterocyclic compounds containing a five-member aromatic ring made up of one sulfur atom, one nitrogen, and three carbon atoms. (2-hydroxyethyl)thiazole2-(4-Methyl-1,3-thiazol-5-yl)ethanol2-(4-METHYL-THIAZOL-5-YL)-ETHANOL2-(4-Methylthiazol-5-yl)ethanol2-(4-Methylthiazole-5-yl)ethanol4-Methyl-5-(.beta.-hydroxyethyl)thiazole4-Methyl-5-(2'-hydroxyethyl)-thiazole4-Methyl-5-(2-hydroxyethyl)-thiazole4-Methyl-5-(2-hydroxyethyl)thiazole4-Methyl-5-(b-hydroxyethyl)thiazole4-Methyl-5-(beta-hydroxyethyl)thiazole4-Methyl-5-(β-hydroxyethyl)thiazole4-Methyl-5-hydroxethylthiazole4-Methyl-5-hydroxyethylthiazole4-Methyl-5-thiazoleethanol4-Methyl-5-thiazolethanol4-Methyl-5-thiazolylethanol5-(2-hydroxyethyl)-4-methylthiazole5-(2-Hydroxyethyl)-4-methylthiazole (sulfurol)5-(2-Hydroxyethyl)-4-methylthiazole (sulphurol)5-(b-Hydroxyethyl)-4-methylthiazole5-(beta-Hydroxyethyl)-4-methylthiazole5-(Hydroxyethyl)-4-methylthiazole5-(β-Hydroxyethyl)-4-methylthiazoleHemineurineHETMHTMHT (van)NChemBio.2007.13-comp11SulfurolSulphurolThiamine breakdown product 4-methyl-5-thiazoleethanol- fromThiamine thiazoleThiazole, 5-(2-hydroxyethyl)-4-methylTHZTZEC6H9NOS143.207143.0404846052-(4-methyl-1,3-thiazol-5-yl)ethan-1-ol4-methyl-5-thiazoleethanol137-00-8CC1=C(CCO)SC=N1InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3BKAWJIRCKVUVED-UHFFFAOYSA-NSolidCytosollogp0.67logs-1.80solubility2.26e+00 g/lmelting_point< 25 oClogp0.42pka_strongest_acidic15.62pka_strongest_basic3.12iupac2-(4-methyl-1,3-thiazol-5-yl)ethan-1-olaverage_mass143.207mono_mass143.040484605smilesCC1=C(CCO)SC=N1formulaC6H9NOSinchiInChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3inchikeyBKAWJIRCKVUVED-UHFFFAOYSA-Npolar_surface_area33.12refractivity37.32polarizability14.92rotatable_bond_count2acceptor_count2donor_count1physiological_charge0formal_charge0Thiamine metabolismec00730Specdb::CMs1069Specdb::CMs3452Specdb::CMs28934Specdb::CMs31627Specdb::CMs32183Specdb::CMs43039Specdb::CMs136145Specdb::CMs143879Specdb::NmrOneD4455Specdb::NmrOneD4576Specdb::NmrOneD4951Specdb::NmrOneD4952Specdb::NmrOneD117258Specdb::NmrOneD117259Specdb::NmrOneD117260Specdb::NmrOneD117261Specdb::NmrOneD117262Specdb::NmrOneD117263Specdb::NmrOneD117264Specdb::NmrOneD117265Specdb::NmrOneD117266Specdb::NmrOneD117267Specdb::NmrOneD117268Specdb::NmrOneD117269Specdb::NmrOneD117270Specdb::NmrOneD117271Specdb::NmrOneD117272Specdb::NmrOneD117273Specdb::NmrOneD117274Specdb::NmrOneD117275Specdb::NmrOneD117276Specdb::NmrOneD117277Specdb::MsMs29102Specdb::MsMs29103Specdb::MsMs29104Specdb::MsMs35660Specdb::MsMs35661Specdb::MsMs35662Specdb::MsMs446465Specdb::MsMs446466Specdb::MsMs446467Specdb::MsMs446468Specdb::MsMs446469Specdb::MsMs448123Specdb::MsMs448124Specdb::MsMs2237966Specdb::MsMs2239623Specdb::MsMs2280334Specdb::MsMs2280335Specdb::MsMs2280336Specdb::MsMs3084457Specdb::MsMs3084458Specdb::MsMs308445911361104C0429417957THZTZEKeseler, I. M., Collado-Vides, J., Santos-Zavaleta, A., Peralta-Gil, M., Gama-Castro, S., Muniz-Rascado, L., Bonavides-Martinez, C., Paley, S., Krummenacker, M., Altman, T., Kaipa, P., Spaulding, A., Pacheco, J., Latendresse, M., Fulcher, C., Sarker, M., Shearer, A. G., Mackie, A., Paulsen, I., Gunsalus, R. P., Karp, P. D. (2011). "EcoCyc: a comprehensive database of Escherichia coli biology." Nucleic Acids Res 39:D583-D590.21097882Kanehisa, M., Goto, S., Sato, Y., Furumichi, M., Tanabe, M. (2012). "KEGG for integration and interpretation of large-scale molecular data sets." Nucleic Acids Res 40:D109-D114.22080510van der Werf, M. J., Overkamp, K. M., Muilwijk, B., Coulier, L., Hankemeier, T. (2007). "Microbial metabolomics: toward a platform with full metabolome coverage." Anal Biochem 370:17-25.17765195Winder, C. L., Dunn, W. B., Schuler, S., Broadhurst, D., Jarvis, R., Stephens, G. M., Goodacre, R. (2008). "Global metabolic profiling of Escherichia coli cultures: an evaluation of methods for quenching and extraction of intracellular metabolites." Anal Chem 80:2939-2948.18331064Hydroxyethylthiazole kinaseP76423THIM_ECOLIthiMhttp://ecmdb.ca/proteins/P76423.xml5-(2-Hydroxyethyl)-4-methylthiazole + Adenosine triphosphate + 4-methyl-5-(2-hydroxyethyl)thiazole <> 4-Methyl-5-(2-phosphoethyl)-thiazole + ADP + Hydrogen ionR04448THIAZOLSYN3-RXNAdenosine triphosphate + 5-(2-Hydroxyethyl)-4-methylthiazole <> ADP + 4-Methyl-5-(2-phosphoethyl)-thiazoleR04448Adenosine triphosphate + 5-(2-Hydroxyethyl)-4-methylthiazole > Hydrogen ion + ADP + 4-Methyl-5-(2-phosphoethyl)-thiazoleR04448THIAZOLSYN3-RXNAdenosine triphosphate + 5-(2-Hydroxyethyl)-4-methylthiazole > ADP + 4-methyl-5-(2-phosphono-oxyethyl)thiazole