2.0 2015-09-18 17:30:02 -0600 2015-09-18 17:30:02 -0600 ECMDB24914 M2MDB007031 Erythrose C4H8O4 120.1039 120.042258744 (3R,4R)-oxolane-2,3,4-triol D-erythro-tetrose O[C@@H]1COC(O)[C@@H]1O InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2/t2-,3-,4?/m1/s1 FMAORJIQYMIRHF-HERZVMAMSA-N logp -2.30 ALOGPS logs 1.08 ALOGPS solubility 1.43e+03 g/l ALOGPS logp -1.7 ChemAxon pka_strongest_acidic 11.32 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac (3R,4R)-oxolane-2,3,4-triol ChemAxon average_mass 120.1039 ChemAxon mono_mass 120.042258744 ChemAxon smiles O[C@@H]1COC(O)[C@@H]1O ChemAxon formula C4H8O4 ChemAxon inchi InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2/t2-,3-,4?/m1/s1 ChemAxon inchikey FMAORJIQYMIRHF-HERZVMAMSA-N ChemAxon polar_surface_area 69.92 ChemAxon refractivity 24 ChemAxon polarizability 10.73 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Vitamin B6 1430936196 PW000891 Metabolic Specdb::CMs 19458 Specdb::CMs 38453 Specdb::CMs 151384 Specdb::NmrOneD 1897 Specdb::NmrOneD 122758 Specdb::NmrOneD 122759 Specdb::NmrOneD 122760 Specdb::NmrOneD 122761 Specdb::NmrOneD 122762 Specdb::NmrOneD 122763 Specdb::NmrOneD 122764 Specdb::NmrOneD 122765 Specdb::NmrOneD 122766 Specdb::NmrOneD 122767 Specdb::NmrOneD 122768 Specdb::NmrOneD 122769 Specdb::NmrOneD 122770 Specdb::NmrOneD 122771 Specdb::NmrOneD 122772 Specdb::NmrOneD 122773 Specdb::NmrOneD 122774 Specdb::NmrOneD 122775 Specdb::NmrOneD 122776 Specdb::NmrOneD 122777 Specdb::MsMs 2119 Specdb::MsMs 2120 Specdb::MsMs 2121 Specdb::MsMs 5785 Specdb::MsMs 309256 Specdb::MsMs 309257 Specdb::MsMs 309258 Specdb::MsMs 353641 Specdb::MsMs 353642 Specdb::MsMs 353643 Specdb::MsMs 448151 Specdb::MsMs 2454568 Specdb::MsMs 2454569 Specdb::MsMs 2454570 Specdb::MsMs 2484015 Specdb::MsMs 2484016 Specdb::MsMs 2484017 Specdb::NmrTwoD 1833 Glucose-specific phosphotransferase enzyme IIA component P69783 PTGA_ECOLI crr http://ecmdb.ca/proteins/P69783.xml PTS system N-acetylmuramic acid-specific EIIBC component P77272 PTYBC_ECOLI murP http://ecmdb.ca/proteins/P77272.xml PTS system N-acetylmuramic acid-specific EIIBC component P77272 PTYBC_ECOLI murP http://ecmdb.ca/proteins/P77272.xml Erythrose + Erythrose > D-Erythrose 4-phosphate + CL(17:0cycw7c/16:1(9Z)/17:0cycw7c/19:0cycv8c) + CL(17:0cycw7c/16:0/17:0cycw7c/16:1(9Z)) PW_RCT000130