2.0 2012-07-30 14:54:40 -0600 2015-06-03 17:20:42 -0600 ECMDB21135 M2MDB001544 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate 2(alpha-d-mannosyl-6-phosphate)-d-glycerate belongs to the class of Hexoses. These are monosaccharides in which the sugar unit is a hexose. (inferred from compound structure) 2(α-D-mannosyl-6-phosphate)-D-glycerate 2(α-D-mannosyl-6-phosphoric acid)-D-glyceric acid 2(a-D-Mannosyl-6-phosphate)-D-glycerate 2(a-D-Mannosyl-6-phosphoric acid)-D-glyceric acid 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate 2(alpha-D-Mannosyl-6-phosphate)-D-glyceric acid 2(alpha-D-Mannosyl-6-phosphoric acid)-D-glyceric acid 2(α-D-Mannosyl-6-phosphate)-D-glycerate 2(α-D-Mannosyl-6-phosphoric acid)-D-glyceric acid C9H14O12P 345.174 345.022287424 3-hydroxy-2-({3,4,5-trihydroxy-6-[(phosphonatooxy)methyl]oxan-2-yl}oxy)propanoate 3-hydroxy-2-({3,4,5-trihydroxy-6-[(phosphonatooxy)methyl]oxan-2-yl}oxy)propanoate OCC(OC1OC(COP([O-])([O-])=O)C(O)C(O)C1O)C([O-])=O InChI=1S/C9H17O12P/c10-1-3(8(14)15)20-9-7(13)6(12)5(11)4(21-9)2-19-22(16,17)18/h3-7,9-13H,1-2H2,(H,14,15)(H2,16,17,18)/p-3 BOLXAGHGKNGVBE-UHFFFAOYSA-K Cytosol logp -2.06 ALOGPS logs -0.67 ALOGPS solubility 8.48e+01 g/l ALOGPS logp -3.4 ChemAxon pka_strongest_acidic 1.22 ChemAxon pka_strongest_basic -3 ChemAxon iupac 3-hydroxy-2-({3,4,5-trihydroxy-6-[(phosphonatooxy)methyl]oxan-2-yl}oxy)propanoate ChemAxon average_mass 345.174 ChemAxon mono_mass 345.022287424 ChemAxon smiles OCC(OC1OC(COP([O-])([O-])=O)C(O)C(O)C1O)C([O-])=O ChemAxon formula C9H14O12P ChemAxon inchi InChI=1S/C9H17O12P/c10-1-3(8(14)15)20-9-7(13)6(12)5(11)4(21-9)2-19-22(16,17)18/h3-7,9-13H,1-2H2,(H,14,15)(H2,16,17,18)/p-3 ChemAxon inchikey BOLXAGHGKNGVBE-UHFFFAOYSA-K ChemAxon polar_surface_area 211.93 ChemAxon refractivity 72.26 ChemAxon polarizability 27.8 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 11 ChemAxon donor_count 4 ChemAxon physiological_charge -3 ChemAxon formal_charge -3 ChemAxon inner membrane transport list of inner membrane transport complexes, transporting compounds from the periplasmic space to the cytosol This pathway should be updated regularly with the new inner membrae transports added PW000786 Metabolic 2-<I>O</I>-α-mannosyl-D-glycerate degradation PWY0-1300 Specdb::NmrOneD 317901 Specdb::NmrOneD 317902 Specdb::NmrOneD 317903 Specdb::NmrOneD 317904 Specdb::NmrOneD 317905 Specdb::NmrOneD 317906 Specdb::NmrOneD 317907 Specdb::NmrOneD 317908 Specdb::NmrOneD 317909 Specdb::NmrOneD 317910 Specdb::NmrOneD 317911 Specdb::NmrOneD 317912 Specdb::NmrOneD 317913 Specdb::NmrOneD 317914 Specdb::NmrOneD 317915 Specdb::NmrOneD 317916 Specdb::NmrOneD 317917 Specdb::NmrOneD 317918 Specdb::NmrOneD 317919 Specdb::NmrOneD 317920 Specdb::MsMs 24584 Specdb::MsMs 24585 Specdb::MsMs 24586 Specdb::MsMs 31142 Specdb::MsMs 31143 Specdb::MsMs 31144 46906104 C16699 60331 CPD0-1063 Keseler, 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. 21097882 Phosphoenolpyruvate-protein phosphotransferase P08839 PT1_ECOLI ptsI http://ecmdb.ca/proteins/P08839.xml Heat-responsive suppressor hrsA P54745 HRSA_ECOLI hrsA http://ecmdb.ca/proteins/P54745.xml Alpha-mannosidase mngB P54746 MNGB_ECOLI mngB http://ecmdb.ca/proteins/P54746.xml Phosphocarrier protein HPr P0AA04 PTHP_ECOLI ptsH http://ecmdb.ca/proteins/P0AA04.xml Mannosyl-D-glycerate transport/metabolism system repressor MngR P13669 MNGR_ECOLI mngR http://ecmdb.ca/proteins/P13669.xml Phosphoenolpyruvic acid + 2(alpha-D-Mannosyl)-D-glycerate > 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate + Pyruvic acid RXN0-2522 Water + 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate > Glyceric acid + Mannose 6-phosphate RXN0-5216 Phosphoenolpyruvic acid + 2(alpha-D-Mannosyl)-D-glycerate > 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate + Pyruvic acid RXN0-2522 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate + Water <> Mannose 6-phosphate + Glyceric acid R09645 2(alpha-D-Mannosyl)-D-glycerate + HPr - phosphorylated > 2(alpha-D-Mannosyl-6-phosphate)-D-glycerate + HPr PW_RCT000177