1.0 2010-04-08 22:04:53 UTC 2019-11-26 02:56:09 UTC FDB001235 D-erythro-L-galacto-Nonulose Present in avocado. D-erythro-L-galacto-Nonulose is found in fruits. C27H54O27 810.7015 810.285246522 1,3,4,5,6,7,8,9-octahydroxynonan-2-one; 1-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]butane-1,2,3,4-tetrol; 2-(hydroxymethyl)-6-(1,2,3-trihydroxypropyl)oxane-2,3,4,5-tetrol 1,3,4,5,6,7,8,9-octahydroxynonan-2-one; 1-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]butane-1,2,3,4-tetrol; 2-(hydroxymethyl)-6-(1,2,3-trihydroxypropyl)oxane-2,3,4,5-tetrol OCC(O)C(O)C(O)C(O)C(O)C(O)C(=O)CO.OCC(O)C(O)C(O)C1OC(O)(CO)C(O)C1O.OCC(O)C(O)C1OC(O)(CO)C(O)C(O)C1O InChI=1S/3C9H18O9/c10-1-3(12)4(13)7-5(14)6(15)8(16)9(17,2-11)18-7;10-1-3(12)4(13)5(14)7-6(15)8(16)9(17,2-11)18-7;10-1-3(12)5(14)7(16)9(18)8(17)6(15)4(13)2-11/h2*3-8,10-17H,1-2H2;3,5-12,14-18H,1-2H2 DKEWTUYUAFDQSI-UHFFFAOYSA-N belongs to the class of organic compounds known as c-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a C-glycosidic bond. C-glycosyl compounds Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Acyloins Alpha-hydroxy ketones Beta-hydroxy ketones Hemiacetals Hydrocarbon derivatives Monosaccharides Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Sugar alcohols Tetrahydrofurans Acyloin Alcohol Aliphatic heteromonocyclic compound Alpha-hydroxy ketone Beta-hydroxy ketone C-glycosyl compound Carbonyl group Hemiacetal Hydrocarbon derivative Ketone Monosaccharide Organic oxide Organoheterocyclic compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Sugar alcohol Tetrahydrofuran logp -4.6 ChemAxon pka_strongest_acidic 12.02 ChemAxon pka_strongest_basic -3 ChemAxon iupac 1,3,4,5,6,7,8,9-octahydroxynonan-2-one; 1-[3,4,5-trihydroxy-5-(hydroxymethyl)oxolan-2-yl]butane-1,2,3,4-tetrol; 2-(hydroxymethyl)-6-(1,2,3-trihydroxypropyl)oxane-2,3,4,5-tetrol ChemAxon average_mass 810.7015 ChemAxon mono_mass 810.285246522 ChemAxon smiles OCC(O)C(O)C(O)C(O)C(O)C(O)C(=O)CO.OCC(O)C(O)C(O)C1OC(O)(CO)C(O)C1O.OCC(O)C(O)C1OC(O)(CO)C(O)C(O)C1O ChemAxon formula C27H54O27 ChemAxon inchi InChI=1S/3C9H18O9/c10-1-3(12)4(13)7-5(14)6(15)8(16)9(17,2-11)18-7;10-1-3(12)4(13)5(14)7-6(15)8(16)9(17,2-11)18-7;10-1-3(12)5(14)7(16)9(18)8(17)6(15)4(13)2-11/h2*3-8,10-17H,1-2H2;3,5-12,14-18H,1-2H2 ChemAxon inchikey DKEWTUYUAFDQSI-UHFFFAOYSA-N ChemAxon polar_surface_area 171.07 ChemAxon refractivity 54.25 ChemAxon polarizability 24.42 ChemAxon rotatable_bond_count 17 ChemAxon acceptor_count 9 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 86037 Specdb::MsMs 86038 Specdb::MsMs 86039 Specdb::MsMs 148263 Specdb::MsMs 148264 Specdb::MsMs 148265 Fruits Unknown generic