2.02012-05-31 14:01:53 -06002015-06-03 15:54:36 -0600ECMDB04007M2MDB000553AllolactoseAllolactose is a disaccharide similar to lactose. It consists of the monosaccharides alpha-D-galactose and alpha-D-glucose linked through a beta 1-6 glycosidic linkage.MelibioseC12H22O11342.2965342.116211546(3R,4S,5S,6R)-6-({[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-2,3,4,5-tetrolallolactose645-03-4[H]C1(O)O[C@]([H])(CO[C@]2([H])O[C@]([H])(CO)[C@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])OInChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11?,12-/m1/s1DLRVVLDZNNYCBX-VDGMBKLFSA-NCytoplasmPeriplasmlogp-3.00logs0.17solubility5.11e+02 g/llogp-4.7pka_strongest_acidic11.25pka_strongest_basic-3iupac(3R,4S,5S,6R)-6-({[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxane-2,3,4,5-tetrolaverage_mass342.2965mono_mass342.116211546smiles[H]C1(O)O[C@]([H])(CO[C@]2([H])O[C@]([H])(CO)[C@]([H])(O)[C@]([H])(O)[C@@]2([H])O)[C@@]([H])(O)[C@]([H])(O)[C@@]1([H])OformulaC12H22O11inchiInChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11?,12-/m1/s1inchikeyDLRVVLDZNNYCBX-VDGMBKLFSA-Npolar_surface_area189.53refractivity68.34polarizability31.12rotatable_bond_count4acceptor_count11donor_count8physiological_charge0formal_charge0Specdb::CMs1084312Specdb::EiMs3627Specdb::NmrOneD275718Specdb::NmrOneD275719Specdb::NmrOneD275720Specdb::NmrOneD275721Specdb::NmrOneD275722Specdb::NmrOneD275723Specdb::NmrOneD275724Specdb::NmrOneD275725Specdb::NmrOneD275726Specdb::NmrOneD275727Specdb::NmrOneD275728Specdb::NmrOneD275729Specdb::NmrOneD275730Specdb::NmrOneD275731Specdb::NmrOneD275732Specdb::NmrOneD275733Specdb::NmrOneD275734Specdb::NmrOneD275735Specdb::NmrOneD275736Specdb::NmrOneD275737Specdb::MsMs27353Specdb::MsMs27354Specdb::MsMs27355Specdb::MsMs33911Specdb::MsMs33912Specdb::MsMs3391311336802495719536229ALLOLACTOSEKeseler, 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-D590.21097882van 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 80:2939-2948.18331064Sugar efflux transporter CP31436SETC_ECOLIsetChttp://ecmdb.ca/proteins/P31436.xmlalpha-Lactose AllolactoseRXN0-5363