{"ymdb_id":"YMDB01091","created_at":"2011-07-21T17:08:38.000Z","updated_at":"2016-09-12T20:56:53.000Z","name":"(2R,3R)-2,3-Dihydroxy-3-methylpentanoate","cas":null,"state":"Solid","melting_point":null,"description":"(2R,3R)-2,3-Dihydroxy-3-methylpentanoate is an intermediate in isoleucine biosynthesis from threonine pathway. [Biocyc ILEUSYN-PWY]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":"mitochondrion","synthesis_reference":null,"chebi_id":"49258","hmdb_id":null,"kegg_id":"C06007","pubchem_id":"21145376","cs_id":null,"foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(2R,3R)-2,3-dihydroxy-3-methylpentanoate","traditional_iupac":"(2R,3R)-2,3-dihydroxy-3-methylpentanoate","logp":"-0.2990653966666666","pka":"13.109092933547867","alogps_solubility":"3.57e+02 g/l","alogps_logp":"-0.01","alogps_logs":"0.34","acceptor_count":"4","donor_count":"2","rotatable_bond_count":"3","polar_surface_area":"80.59","refractivity":"44.8016","polarizability":"13.981880027832783","formal_charge":"-1","physiological_charge":"-1","pka_strongest_basic":"-3.320314291594766","pka_strongest_acidic":"3.930562552523404","bioavailability":"1","number_of_rings":"0","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["(2R,3R)-2,3-Dihydroxy-3-methylpentanoate","(R)-2,3-Dihydroxy-3-methylpentanoate","(R)-2,3-Dihydroxy-3-methylvalerate"],"pathways":[{"name":"Valine, leucine and isoleucine biosynthesis","kegg_map_id":"00290"}],"growth_conditions":[],"references":[],"proteins":[]}