2.0 2015-07-03 14:16:56 -0600 2015-08-05 16:22:05 -0600 ECMDB23946 M2MDB006055 beta-L-Fucopyranose A L-fucopyranose with a β-configuration at the anomeric position b-L-Fucopyranose b-L-Fucose beta-L-Fucose β-L-Fucopyranose β-L-Fucose C6H12O5 164.1565 164.068473494 (2S,3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol β-l-fucose C[C@@H]1O[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6-/m0/s1 SHZGCJCMOBCMKK-KGJVWPDLSA-N logp -2.39 ALOGPS logs 0.70 ALOGPS solubility 8.27e+02 g/l ALOGPS logp -1.9 ChemAxon pka_strongest_acidic 11.3 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac (2S,3S,4R,5S,6S)-6-methyloxane-2,3,4,5-tetrol ChemAxon average_mass 164.1565 ChemAxon mono_mass 164.068473494 ChemAxon smiles C[C@@H]1O[C@H](O)[C@@H](O)[C@H](O)[C@@H]1O ChemAxon formula C6H12O5 ChemAxon inchi InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6-/m0/s1 ChemAxon inchikey SHZGCJCMOBCMKK-KGJVWPDLSA-N ChemAxon polar_surface_area 90.15 ChemAxon refractivity 34.38 ChemAxon polarizability 15.28 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 5 ChemAxon donor_count 4 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 33775 Specdb::CMs 47821 Specdb::CMs 160215 Specdb::NmrOneD 51642 Specdb::NmrOneD 51643 Specdb::NmrOneD 51644 Specdb::NmrOneD 51645 Specdb::NmrOneD 51646 Specdb::NmrOneD 51647 Specdb::NmrOneD 51648 Specdb::NmrOneD 51649 Specdb::NmrOneD 51650 Specdb::NmrOneD 51651 Specdb::NmrOneD 51652 Specdb::NmrOneD 51653 Specdb::NmrOneD 51654 Specdb::NmrOneD 51655 Specdb::NmrOneD 51656 Specdb::NmrOneD 51657 Specdb::NmrOneD 51658 Specdb::NmrOneD 51659 Specdb::NmrOneD 51660 Specdb::NmrOneD 51661 Specdb::MsMs 28682 Specdb::MsMs 28683 Specdb::MsMs 28684 Specdb::MsMs 35240 Specdb::MsMs 35241 Specdb::MsMs 35242 Specdb::MsMs 2424484 Specdb::MsMs 2424485 Specdb::MsMs 2424486 Specdb::MsMs 2514592 Specdb::MsMs 2514593 Specdb::MsMs 2514594 C20836 alpha-L-Fucopyranose <> beta-L-Fucopyranose R10764