1.0 2026-09-22 07:31:28 UTC 2026-09-22 07:31:28 UTC FDB117898 D-Allopyranose (3R,4R,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol (3R,4R,5S,6R)-6-(hydroxymethyl)tetrahydropyran-2,3,4,5-tetrol C6H12O6 180.1559 180.063388116 (3R,4R,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol D-allopyranose [H]C1(O)O[C@]([H])(CO)[C@@]([H])(O)[C@@]([H])(O)[C@@]1([H])O InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5-,6?/m1/s1 WQZGKKKJIJFFOK-IVMDWMLBSA-N belongs to the class of organic compounds known as hexoses. These are monosaccharides in which the sugar unit is a is a six-carbon containing moeity. Hexoses Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aliphatic heteromonocyclic compounds Hemiacetals Hydrocarbon derivatives Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic heteromonocyclic compound Hemiacetal Hexose monosaccharide Hydrocarbon derivative Organoheterocyclic compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Aldoses D-allose allopyranose logp -2.57 ALOGPS logs 0.64 ALOGPS solubility 7.82e+02 g/l ALOGPS logp -2.9 ChemAxon pka_strongest_acidic 11.3 ChemAxon pka_strongest_basic -3 ChemAxon iupac (3R,4R,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol ChemAxon average_mass 180.1559 ChemAxon mono_mass 180.063388116 ChemAxon smiles [H]C1(O)O[C@]([H])(CO)[C@@]([H])(O)[C@@]([H])(O)[C@@]1([H])O ChemAxon formula C6H12O6 ChemAxon inchi InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5-,6?/m1/s1 ChemAxon inchikey WQZGKKKJIJFFOK-IVMDWMLBSA-N ChemAxon polar_surface_area 110.38 ChemAxon refractivity 35.92 ChemAxon polarizability 16.15 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 6 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 30506 Specdb::CMs 30507 Specdb::MsMs 26996 Specdb::MsMs 26997 Specdb::MsMs 26998 Specdb::MsMs 33554 Specdb::MsMs 33555 Specdb::MsMs 33556 Specdb::NmrOneD 259528 Specdb::NmrOneD 259529 Specdb::NmrOneD 259530 Specdb::NmrOneD 259531 Specdb::NmrOneD 259532 Specdb::NmrOneD 259533 Specdb::NmrOneD 259534 Specdb::NmrOneD 259535 Specdb::NmrOneD 259536 Specdb::NmrOneD 259537 Specdb::NmrOneD 259538 Specdb::NmrOneD 259539 Specdb::NmrOneD 259540 Specdb::NmrOneD 259541 Specdb::NmrOneD 259542 Specdb::NmrOneD 259543 Specdb::NmrOneD 259544 Specdb::NmrOneD 259545 Specdb::NmrOneD 259546 Specdb::NmrOneD 259547