{"ymdb_id":"YMDB02317","created_at":"2012-06-08T21:51:42.000Z","updated_at":"2016-09-08T18:37:50.000Z","name":"4-deoxypyridoxine","cas":"61-67-6","state":null,"melting_point":null,"description":"4-Deoxypyridoxine is a derivative of vitamin B6 that acts an antagonist to vitamin B6.","experimental_water_solubility":null,"experimental_logp_hydrophobicity":null,"location":null,"synthesis_reference":null,"chebi_id":null,"hmdb_id":null,"kegg_id":null,"pubchem_id":"6094","cs_id":"5869","foodb_id":null,"wikipedia_link":null,"biocyc_id":null,"iupac":"5-(hydroxymethyl)-2,4-dimethylpyridin-3-ol","traditional_iupac":"4-deoxypyridoxine","logp":"0.32944985833333346","pka":"14.936173266273713","alogps_solubility":"2.63e+01 g/l","alogps_logp":"0.38","alogps_logs":"-0.76","acceptor_count":"3","donor_count":"2","rotatable_bond_count":"1","polar_surface_area":"53.35000000000001","refractivity":"42.3306","polarizability":"16.240002204893177","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"6.673690219362241","pka_strongest_acidic":"9.408001830564865","bioavailability":"1","number_of_rings":"1","rule_of_five":"1","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["4-Deoxypyridoxal","4-Deoxypyridoxol","alpha4-Norpyridoxine","Deoxypyridoxine","Desoxypyridoxine"],"pathways":[],"growth_conditions":[],"references":[{"pubmed_id":17439666,"citation":"Castrillo, J. I., Zeef, L. A., Hoyle, D. C., Zhang, N., Hayes, A., Gardner, D. C., Cornell, M. J., Petty, J., Hakes, L., Wardleworth, L., Rash, B., Brown, M., Dunn, W. B., Broadhurst, D., O'Donoghue, K., Hester, S. S., Dunkley, T. P., Hart, S. R., Swainston, N., Li, P., Gaskell, S. J., Paton, N. W., Lilley, K. S., Kell, D. B., Oliver, S. G. (2007). \"Growth control of the eukaryote cell: a systems biology study in yeast.\" J Biol 6:4."}],"proteins":[]}