1.0 2010-04-08 22:15:43 UTC 2019-11-26 03:20:25 UTC FDB021472 1-Deoxy-D-glucitol Constituent of the fruit of Foeniculum vulgare (fennel). 1-Deoxy-D-glucitol is found in herbs and spices. 1-Deoxy-D-glucitol 6-Deoxy-L-gulitol C6H14O5 166.1724 166.084123558 hexane-1,2,3,4,5-pentol fucitol 18545-96-5 CC(O)C(O)C(O)C(O)CO InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3 SKCKOFZKJLZSFA-UHFFFAOYSA-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 acyclic compounds Fatty alcohols Hydrocarbon derivatives Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic acyclic compound Fatty acyl Fatty alcohol Hexose monosaccharide Hydrocarbon derivative Polyol Primary alcohol Secondary alcohol a sugar alcohol logp -2.25 ALOGPS logs 0.46 ALOGPS solubility 4.76e+02 g/l ALOGPS melting_point Mp 131-132° logp -2.7 ChemAxon pka_strongest_acidic 12.7 ChemAxon pka_strongest_basic -3 ChemAxon iupac hexane-1,2,3,4,5-pentol ChemAxon average_mass 166.1724 ChemAxon mono_mass 166.084123558 ChemAxon smiles CC(O)C(O)C(O)C(O)CO ChemAxon formula C6H14O5 ChemAxon inchi InChI=1S/C6H14O5/c1-3(8)5(10)6(11)4(9)2-7/h3-11H,2H2,1H3 ChemAxon inchikey SKCKOFZKJLZSFA-UHFFFAOYSA-N ChemAxon polar_surface_area 101.15 ChemAxon refractivity 36.86 ChemAxon polarizability 16.3 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 5 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10786 Specdb::CMs 47349 Specdb::CMs 118496 Specdb::CMs 128205 Specdb::CMs 154305 Specdb::MsMs 289726 Specdb::MsMs 289727 Specdb::MsMs 289728 Specdb::MsMs 329248 Specdb::MsMs 329249 Specdb::MsMs 329250 Specdb::MsMs 2693105 Specdb::MsMs 2693106 Specdb::MsMs 2693107 Specdb::MsMs 2985922 Specdb::MsMs 2985923 Specdb::MsMs 2985924 Specdb::NmrOneD 47022 Specdb::NmrOneD 47023 Specdb::NmrOneD 47024 Specdb::NmrOneD 47025 Specdb::NmrOneD 47026 Specdb::NmrOneD 47027 Specdb::NmrOneD 47028 Specdb::NmrOneD 47029 Specdb::NmrOneD 47030 Specdb::NmrOneD 47031 Specdb::NmrOneD 47032 Specdb::NmrOneD 47033 Specdb::NmrOneD 47034 Specdb::NmrOneD 47035 Specdb::NmrOneD 47036 Specdb::NmrOneD 47037 Specdb::NmrOneD 47038 Specdb::NmrOneD 47039 Specdb::NmrOneD 47040 Specdb::NmrOneD 47041 HMDB41500 #<Reference:0x000055ce33622bc0> Herbs and Spices Unknown generic