1.0 2010-04-08 22:06:45 UTC 2025-11-18 22:59:35 UTC FDB005602 Dihydrozeatin O-beta-D-Glucoside Dihydrozeatin o-beta-d-glucoside is a member of the class of compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Dihydrozeatin o-beta-d-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Dihydrozeatin o-beta-d-glucoside can be found in soy bean, which makes dihydrozeatin o-beta-d-glucoside a potential biomarker for the consumption of this food product. C16H25N5O6 383.3996 383.180483557 2-(hydroxymethyl)-6-{2-methyl-4-[(7H-purin-6-yl)amino]butoxy}oxane-3,4,5-triol 2-(hydroxymethyl)-6-[2-methyl-4-(7H-purin-6-ylamino)butoxy]oxane-3,4,5-triol CC(CCNC1=NC=NC2=C1NC=N2)COC1OC(CO)C(O)C(O)C1O InChI=1S/C16H25N5O6/c1-8(2-3-17-14-10-15(19-6-18-10)21-7-20-14)5-26-16-13(25)12(24)11(23)9(4-22)27-16/h6-9,11-13,16,22-25H,2-5H2,1H3,(H2,17,18,19,20,21) QRZHDHJUYBONQQ-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Fatty acyl glycosides of mono- and disaccharides Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acyl glycosides Aromatic heteropolycyclic compounds 6-alkylaminopurines Acetals Alkyl glycosides Aminopyrimidines and derivatives Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Imidazoles Imidolactams Monosaccharides O-glycosyl compounds Organopnictogen compounds Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Secondary alkylarylamines 6-alkylaminopurine 6-aminopurine Acetal Alcohol Alkyl glycoside Amine Aminopyrimidine Aromatic heteropolycyclic compound Azacycle Azole Fatty acyl glycoside of mono- or disaccharide Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Imidazole Imidazopyrimidine Imidolactam Monosaccharide O-glycosyl compound Organic nitrogen compound Organic oxygen compound Organoheterocyclic compound Organonitrogen compound Organooxygen compound Organopnictogen compound Oxacycle Oxane Polyol Primary alcohol Purine Pyrimidine Secondary alcohol Secondary aliphatic/aromatic amine Secondary amine a glucoside logp -0.55 ALOGPS logs -1.88 ALOGPS solubility 5.06e+00 g/l ALOGPS logp -1.8 ChemAxon pka_strongest_acidic 10.22 ChemAxon pka_strongest_basic 5.2 ChemAxon iupac 2-(hydroxymethyl)-6-{2-methyl-4-[(7H-purin-6-yl)amino]butoxy}oxane-3,4,5-triol ChemAxon average_mass 383.3996 ChemAxon mono_mass 383.180483557 ChemAxon smiles CC(CCNC1=NC=NC2=C1NC=N2)COC1OC(CO)C(O)C(O)C1O ChemAxon formula C16H25N5O6 ChemAxon inchi InChI=1S/C16H25N5O6/c1-8(2-3-17-14-10-15(19-6-18-10)21-7-20-14)5-26-16-13(25)12(24)11(23)9(4-22)27-16/h6-9,11-13,16,22-25H,2-5H2,1H3,(H2,17,18,19,20,21) ChemAxon inchikey QRZHDHJUYBONQQ-UHFFFAOYSA-N ChemAxon polar_surface_area 165.87 ChemAxon refractivity 96.4 ChemAxon polarizability 39.27 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 10 ChemAxon donor_count 6 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 54147 Specdb::MsMs 54148 Specdb::MsMs 54149 Specdb::MsMs 173199 Specdb::MsMs 173200 Specdb::MsMs 173201 Specdb::MsMs 3601940 Specdb::MsMs 3601941 Specdb::MsMs 3601942 Specdb::MsMs 3603287 Specdb::MsMs 3603288 Specdb::MsMs 3603289 Soy bean Type 1 specific Glycine max 3847