1.0 2010-04-08 22:14:53 UTC 2025-11-19 02:28:59 UTC FDB020235 6-Hydroxykaempferol 3,6-diglucoside 6-hydroxykaempferol 3,6-diglucoside is a member of the class of compounds known as flavonoid-3-o-glycosides. Flavonoid-3-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. 6-hydroxykaempferol 3,6-diglucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 6-hydroxykaempferol 3,6-diglucoside can be found in safflower, which makes 6-hydroxykaempferol 3,6-diglucoside a potential biomarker for the consumption of this food product. 3,4',5,6,7-Pentahydroxyflavone 3,6-di-O-b-D-glucopyranoside 3,4',5,6,7-Pentahydroxyflavone 3,6-di-O-b-D-glucoside 6-Hydroxykaempferol 3,6-diglucoside C27H30O17 626.5169 626.148299534 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-4H-chromen-4-one 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})chromen-4-one 142674-16-6 OCC1OC(OC2=C(O)C3=C(OC(C4=CC=C(O)C=C4)=C(OC4OC(CO)C(O)C(O)C4O)C3=O)C=C2O)C(O)C(O)C1O InChI=1S/C27H30O17/c28-6-12-15(32)19(36)21(38)26(41-12)43-24-10(31)5-11-14(17(24)34)18(35)25(23(40-11)8-1-3-9(30)4-2-8)44-27-22(39)20(37)16(33)13(7-29)42-27/h1-5,12-13,15-16,19-22,26-34,36-39H,6-7H2 GIHCVNUAKOTVCJ-UHFFFAOYSA-N belongs to the class of organic compounds known as triacylglycerols. These are glycerides consisting of three fatty acid chains covalently bonded to a glycerol molecule through ester linkages. Triacylglycerols Organic compounds Lipids and lipid-like molecules Glycerolipids Triradylcglycerols Aliphatic acyclic compounds Carbonyl compounds Carboxylic acid esters Fatty acid esters Hydrocarbon derivatives Organic oxides Tricarboxylic acids and derivatives Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Fatty acyl Hydrocarbon derivative Organic oxide Organic oxygen compound Organooxygen compound Triacyl-sn-glycerol Tricarboxylic acid or derivatives logp -0.78 ALOGPS logs -2.01 ALOGPS solubility 6.11e+00 g/l ALOGPS melting_point Mp 183-186° logp -2.4 ChemAxon pka_strongest_acidic 6.76 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 5,7-dihydroxy-2-(4-hydroxyphenyl)-3,6-bis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-4H-chromen-4-one ChemAxon average_mass 626.5169 ChemAxon mono_mass 626.148299534 ChemAxon smiles OCC1OC(OC2=C(O)C3=C(OC(C4=CC=C(O)C=C4)=C(OC4OC(CO)C(O)C(O)C4O)C3=O)C=C2O)C(O)C(O)C1O ChemAxon formula C27H30O17 ChemAxon inchi InChI=1S/C27H30O17/c28-6-12-15(32)19(36)21(38)26(41-12)43-24-10(31)5-11-14(17(24)34)18(35)25(23(40-11)8-1-3-9(30)4-2-8)44-27-22(39)20(37)16(33)13(7-29)42-27/h1-5,12-13,15-16,19-22,26-34,36-39H,6-7H2 ChemAxon inchikey GIHCVNUAKOTVCJ-UHFFFAOYSA-N ChemAxon polar_surface_area 285.75 ChemAxon refractivity 141.42 ChemAxon polarizability 59.34 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 17 ChemAxon donor_count 11 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 1025270 Specdb::MsMs 1025271 Specdb::MsMs 1025272 Specdb::MsMs 1148813 Specdb::MsMs 1148814 Specdb::MsMs 1148815 Safflower Type 1 specific Carthamus tinctorius 4222