1.0 2010-04-08 22:09:02 UTC 2025-11-18 23:19:00 UTC FDB010269 Sodium glucoheptonate It is used as a food additive . D-gluco-Heptonic acid, monosodium salt, (2.xi.)- D-Gluco-heptonic acid, monosodium salt, (2.xi)- D-gluco-Heptonic acid, monosodium salt, (2xi)- D-gluco-Heptonic acid, sodium salt (1:1), (2xi)- Gluceptate sodium Monosodium d-glucoheptonate C7H13NaO8 248.1631 248.050812067 sodium (3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate sodium (2xi)-D-gluco-heptonate 31138-65-5 [Na+].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)C([O-])=O InChI=1S/C7H14O8.Na/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;/h2-6,8-13H,1H2,(H,14,15);/q;+1/p-1/t2-,3-,4+,5-,6?;/m1./s1 FMYOMWCQJXWGEN-BMZZJELJSA-M belongs to the class of organic compounds known as sugar acids and derivatives. Sugar acids and derivatives are compounds containing a saccharide unit which bears a carboxylic acid group. Sugar acids and derivatives Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aliphatic acyclic compounds Beta hydroxy acids and derivatives Carbonyl compounds Carboxylic acid salts Carboxylic acids Heptoses Hydrocarbon derivatives Hydroxy fatty acids Medium-chain fatty acids Medium-chain hydroxy acids and derivatives Monocarboxylic acids and derivatives Organic oxides Organic sodium salts Organic zwitterions Polyols Primary alcohols Secondary alcohols Alcohol Aliphatic acyclic compound Beta-hydroxy acid Carbonyl group Carboxylic acid Carboxylic acid derivative Carboxylic acid salt Fatty acid Fatty acyl Heptose monosaccharide Hydrocarbon derivative Hydroxy acid Hydroxy fatty acid Medium-chain fatty acid Medium-chain hydroxy acid Monocarboxylic acid or derivatives Monosaccharide Organic alkali metal salt Organic oxide Organic salt Organic sodium salt Organic zwitterion Polyol Primary alcohol Secondary alcohol Sugar acid logp -2.19 ALOGPS logs 0.07 ALOGPS solubility 2.89e+02 g/l ALOGPS logp -4 ChemAxon pka_strongest_acidic 3.38 ChemAxon pka_strongest_basic -3 ChemAxon iupac sodium (3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoate ChemAxon average_mass 248.1631 ChemAxon mono_mass 248.050812067 ChemAxon smiles [Na+].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)C([O-])=O ChemAxon formula C7H13NaO8 ChemAxon inchi InChI=1S/C7H14O8.Na/c8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;/h2-6,8-13H,1H2,(H,14,15);/q;+1/p-1/t2-,3-,4+,5-,6?;/m1./s1 ChemAxon inchikey FMYOMWCQJXWGEN-BMZZJELJSA-M ChemAxon polar_surface_area 161.51 ChemAxon refractivity 55.07 ChemAxon polarizability 19.29 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 8 ChemAxon donor_count 6 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1252537 Specdb::MsMs 1252538 Specdb::MsMs 1252539 Specdb::MsMs 1367782 Specdb::MsMs 1367783 Specdb::MsMs 1367784