1.0 2010-04-08 22:14:44 UTC 2025-11-19 02:27:30 UTC FDB020016 Quercetin 3-[rhamnosyl-(1->2)-rhamnosyl-(1->6)-glucoside] Isolated from Humulus lupulus (hops). Quercetin 3-[rhamnosyl-(1->2)-rhamnosyl-(1->6)-glucoside] is found in alcoholic beverages. Quercetin 3-[rhamnosyl-(1->2)-rhamnosyl-(1->6)-glucoside] Quercetin 3-rhamnosyl-(1->2)-rhamnosyl-(1->6)-glucoside Rutin 2'''-O-a-L-rhamnopyranoside C33H40O20 756.6587 756.21129372 3-({6-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one 3-({6-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one 32453-37-5 CC1OC(OC2C(O)C(O)C(C)OC2OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)53-30-25(44)20(39)10(2)49-33(30)47-8-17-21(40)24(43)27(46)32(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3 ZKLZXRYXKRWGQP-UHFFFAOYSA-N belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. Fatty acid esters Organic compounds Lipids and lipid-like molecules Fatty Acyls Fatty acid esters Aliphatic acyclic compounds Carbonyl compounds Carboxylic acid esters Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Aliphatic acyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Fatty acid ester Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound logp -0.10 ALOGPS logs -1.98 ALOGPS solubility 7.87e+00 g/l ALOGPS logp -1.6 ChemAxon pka_strongest_acidic 6.43 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3-({6-[({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one ChemAxon average_mass 756.6587 ChemAxon mono_mass 756.21129372 ChemAxon smiles CC1OC(OC2C(O)C(O)C(C)OC2OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O ChemAxon formula C33H40O20 ChemAxon inchi InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)53-30-25(44)20(39)10(2)49-33(30)47-8-17-21(40)24(43)27(46)32(51-17)52-29-22(41)18-15(37)6-12(34)7-16(18)50-28(29)11-3-4-13(35)14(36)5-11/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3 ChemAxon inchikey ZKLZXRYXKRWGQP-UHFFFAOYSA-N ChemAxon polar_surface_area 324.44 ChemAxon refractivity 171.01 ChemAxon polarizability 72.07 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 20 ChemAxon donor_count 12 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 780917 Specdb::CMs 780918 Specdb::CMs 780919 Specdb::CMs 780920 Specdb::CMs 780921 Specdb::CMs 780922 Specdb::CMs 780923 Specdb::CMs 780924 Specdb::CMs 780925 Specdb::CMs 780926 Specdb::CMs 780927 Specdb::CMs 780928 Specdb::CMs 780929 Specdb::CMs 780930 Specdb::CMs 780931 Specdb::CMs 780932 Specdb::CMs 780933 Specdb::CMs 780934 Specdb::CMs 780935 Specdb::CMs 780936 Specdb::CMs 780937 Specdb::CMs 780938 Specdb::CMs 780939 Specdb::CMs 780940 Specdb::MsMs 6707 Specdb::MsMs 6708 Specdb::MsMs 6709 Specdb::MsMs 11849 Specdb::MsMs 11850 Specdb::MsMs 11851 Specdb::MsMs 13379 Specdb::MsMs 13380 Specdb::MsMs 13381 Specdb::MsMs 18521 Specdb::MsMs 18522 Specdb::MsMs 18523 Specdb::MsMs 2658907 Specdb::MsMs 2658908 Specdb::MsMs 2658909 Specdb::MsMs 3050675 Specdb::MsMs 3050676 Specdb::MsMs 3050677 Specdb::NmrOneD 39642 Specdb::NmrOneD 39643 Specdb::NmrOneD 39644 Specdb::NmrOneD 39645 Specdb::NmrOneD 39646 Specdb::NmrOneD 39647 Specdb::NmrOneD 39648 Specdb::NmrOneD 39649 Specdb::NmrOneD 39650 Specdb::NmrOneD 39651 Specdb::NmrOneD 39652 Specdb::NmrOneD 39653 Specdb::NmrOneD 39654 Specdb::NmrOneD 39655 Specdb::NmrOneD 39656 Specdb::NmrOneD 39657 Specdb::NmrOneD 39658 Specdb::NmrOneD 39659 Specdb::NmrOneD 39660 Specdb::NmrOneD 39661 HMDB40294 #<Reference:0x000055ce31ef8530> Alcoholic beverages Unknown generic