1.0 2011-03-17 23:25:44 UTC 2025-11-19 02:38:53 UTC FDB021655 Daphnetin glucoside Daphnetin glucoside is a member of the class of compounds known as coumarin glycosides. Coumarin glycosides are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety. Daphnetin glucoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Daphnetin glucoside can be found in coriander, which makes daphnetin glucoside a potential biomarker for the consumption of this food product. 7,8-Dihydroxy-2H-1-benzopyran-2-one; 8-O-b-D-Glucopyranoside Daphnetin glucoside C15H16O9 340.2821 340.07943211 7-hydroxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one 7-hydroxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-2-one 20853-56-9 OCC1OC(OC2=C3OC(=O)C=CC3=CC=C2O)C(O)C(O)C1O InChI=1S/C15H16O9/c16-5-8-10(19)11(20)12(21)15(22-8)24-14-7(17)3-1-6-2-4-9(18)23-13(6)14/h1-4,8,10-12,15-17,19-21H,5H2 MMPBHSBVPREJQC-UHFFFAOYSA-N belongs to the class of organic compounds known as coumarin glycosides. These are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety. Coumarin glycosides Organic compounds Phenylpropanoids and polyketides Coumarins and derivatives Coumarin glycosides Aromatic heteropolycyclic compounds 1-benzopyrans 1-hydroxy-2-unsubstituted benzenoids 7-hydroxycoumarins Acetals Heteroaromatic compounds Hexoses Hydrocarbon derivatives Lactones O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Pyranones and derivatives Secondary alcohols 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 7-hydroxycoumarin Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Coumarin o-glycoside Coumarin-8-o-glycoside Glycosyl compound Heteroaromatic compound Hexose monosaccharide Hydrocarbon derivative Hydroxycoumarin Lactone Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Pyran Pyranone Secondary alcohol logp -0.55 ALOGPS logs -1.45 ALOGPS solubility 1.22e+01 g/l ALOGPS melting_point Mp 223-224? logp -1.1 ChemAxon pka_strongest_acidic 8.24 ChemAxon pka_strongest_basic -3 ChemAxon iupac 7-hydroxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one ChemAxon average_mass 340.2821 ChemAxon mono_mass 340.07943211 ChemAxon smiles OCC1OC(OC2=C3OC(=O)C=CC3=CC=C2O)C(O)C(O)C1O ChemAxon formula C15H16O9 ChemAxon inchi InChI=1S/C15H16O9/c16-5-8-10(19)11(20)12(21)15(22-8)24-14-7(17)3-1-6-2-4-9(18)23-13(6)14/h1-4,8,10-12,15-17,19-21H,5H2 ChemAxon inchikey MMPBHSBVPREJQC-UHFFFAOYSA-N ChemAxon polar_surface_area 145.91 ChemAxon refractivity 77.65 ChemAxon polarizability 30.95 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1225654 Specdb::MsMs 1225655 Specdb::MsMs 1225656 Specdb::MsMs 1341256 Specdb::MsMs 1341257 Specdb::MsMs 1341258 Specdb::MsMs 3606682 Specdb::MsMs 3606683 Specdb::MsMs 3606684 Specdb::MsMs 3606685 Specdb::MsMs 3606686 Specdb::MsMs 3606687 Coriander Type 1 specific Coriandrum sativum 4047