{"ymdb_id":"YMDB00865","created_at":"2011-05-29T18:59:23.000Z","updated_at":"2016-09-08T18:35:59.000Z","name":"L-xylono-1,4-lactone","cas":null,"state":null,"melting_point":null,"description":"L-Xylono-1,4-lactone is the oxidation product of L-xylose by the L-xylose 1-dehydrogenase. [Biocyc L-XYLOSE-1-DEHYDROGENASE-RXN]","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":"18118","hmdb_id":null,"kegg_id":"C02994","pubchem_id":"439873","cs_id":"23936492","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"(3S,4S,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-one","traditional_iupac":"L-xylono-1,4-lactone","logp":"-2.114938244","pka":"13.66228265576019","alogps_solubility":"8.47e+02 g/l","alogps_logp":"-1.98","alogps_logs":"0.76","acceptor_count":"4","donor_count":"3","rotatable_bond_count":"1","polar_surface_area":"86.99000000000001","refractivity":"28.8163","polarizability":"12.784249751374606","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-2.9894265691123385","pka_strongest_acidic":"11.633837675631321","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["L-Xylono-1,4-lactone"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":21062828,"citation":"Scheer, M., Grote, A., Chang, A., Schomburg, I., Munaretto, C., Rother, M., Sohngen, C., Stelzer, M., Thiele, J., Schomburg, D. (2011). \"BRENDA, the enzyme information system in 2011.\" Nucleic Acids Res 39:D670-D676."}],"proteins":[]}