{"ymdb_id":"YMDB00895","created_at":"2011-05-29T19:02:24.000Z","updated_at":"2016-09-08T18:36:02.000Z","name":"Melibiose","cas":"585-99-9","state":"Solid","melting_point":"84 oC","description":"Melibiose is a disaccharide consisting of one galactose and one glucose moiety in an alpha (1-\u003e6) glycosidic linkage. This sugar is produced and metabolized only by enteric and lactic acid bacteria and other microbes.","experimental_water_solubility":"1000 mg/mL [MERCK INDEX (1996)]","experimental_logp_hydrophobicity":"","location":"extracellular;cytoplasm","synthesis_reference":"Pictet, Ame; Vogel, Hans.  The synthesis of melibiose.  Helvetica Chimica Acta  (1927),  10  280.","chebi_id":"28053","hmdb_id":"HMDB00048","kegg_id":"C05402","pubchem_id":"440658","cs_id":"23130964","foodb_id":null,"wikipedia_link":"Melibiose","biocyc_id":"MELIBIOSE","iupac":"(2S,3R,4S,5R,6R)-6-({[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-2,3,4,5-tetrol","traditional_iupac":"epimelibiose","logp":"-4.703374863666666","pka":"12.133081366054801","alogps_solubility":"5.11e+02 g/l","alogps_logp":"-3.00","alogps_logs":"0.17","acceptor_count":"11","donor_count":"8","rotatable_bond_count":"4","polar_surface_area":"189.52999999999997","refractivity":"68.3367","polarizability":"30.85361818839388","formal_charge":"0","physiological_charge":"0","pka_strongest_basic":"-2.981083422322401","pka_strongest_acidic":"11.248198780146973","bioavailability":"0","number_of_rings":"2","rule_of_five":"0","ghose_filter":"0","veber_rule":"0","mddr_like_rule":"0","synonyms":["6-(a-D-galactosido)-D-glucose","6-(a-delta-galactosido)-delta-glucose","6-(D-galactosido)-D-glucose","6-(D-galactosido)-delta-glucose","6-O-a-D-galactopyranosyl-D-Glucose","6-O-alpha-D-galactopyranosyl-D-Glucose","6-O-alpha-delta-galactopyranosyl-delta-Glucose","6-O-Hexopyranosylhexose","alpha-D-Melibiose","alpha-delta-Melibiose","alpha-Melibiose","D-(+)-Melibiose","D-Melibiose","delta-(+)-Melibiose","delta-Melibiose","Melibiose","Mellibiose"],"pathways":[{"name":"Galactose metabolism","kegg_map_id":"00052"}],"growth_conditions":[],"references":[{"pubmed_id":18846089,"citation":"Herrgard, M. J., Swainston, N., Dobson, P., Dunn, W. B., Arga, K. Y., Arvas, M., Bluthgen, N., Borger, S., Costenoble, R., Heinemann, M., Hucka, M., Le Novere, N., Li, P., Liebermeister, W., Mo, M. L., Oliveira, A. P., Petranovic, D., Pettifer, S., Simeonidis, E., Smallbone, K., Spasic, I., Weichart, D., Brent, R., Broomhead, D. S., Westerhoff, H. V., Kirdar, B., Penttila, M., Klipp, E., Palsson, B. O., Sauer, U., Oliver, S. G., Mendes, P., Nielsen, J., Kell, D. B. (2008). \"A consensus yeast metabolic network reconstruction obtained from a community approach to systems biology.\" Nat Biotechnol 26:1155-1160."},{"pubmed_id":6267434,"citation":"Buckholz, R. G., Adams, B. G. (1981). \"Induction and genetics of two alpha-galactosidase activities in Saccharomyces cerevisiae.\" Mol Gen Genet 182:77-81."}],"proteins":[]}