1.0 2010-04-08 22:12:51 UTC 2025-11-19 01:52:16 UTC FDB017133 Quercetin 3-(2G-rhamnosylrutinoside) Isolated from Glycine max (soybean) and Humulus lupulus (hops). Quercetin 3-(2G-rhamnosylrutinoside) is found in many foods, some of which are pulses, redcurrant, alcoholic beverages, and soy bean. Manghaslin Quercetin 3-(2G-rhamnosylrutinoside) Quercetin 3-2g-rhamnosylrutinoside Rutin 2''-O-a-L-rhamnopyranoside C33H40O20 756.6587 756.21129372 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one 55696-57-6 CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(OC3OC(C)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(48-9)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(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 HKNBJSRIYRDSLB-UHFFFAOYSA-N belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Flavonoid-3-O-glycosides Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Acetals Benzene and substituted derivatives Catechols Chromones Flavones Heteroaromatic compounds Hydrocarbon derivatives O-glycosyl compounds Oligosaccharides Organic oxides Oxacyclic compounds Oxanes Polyols Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Catechol Chromone Flavone Flavonoid-3-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety O-glycosyl compound Oligosaccharide Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Polyol Pyran Pyranone Secondary alcohol Vinylogous acid logp -0.07 ALOGPS logs -1.93 ALOGPS solubility 8.91e+00 g/l ALOGPS melting_point Mp 194-196° logp -1.6 ChemAxon pka_strongest_acidic 6.43 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-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(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(OC3OC(C)C(O)C(O)C3O)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)47-8-17-21(40)25(44)30(53-32-27(46)24(43)20(39)10(2)49-32)33(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 HKNBJSRIYRDSLB-UHFFFAOYSA-N ChemAxon polar_surface_area 324.44 ChemAxon refractivity 171.01 ChemAxon polarizability 72.34 ChemAxon rotatable_bond_count 8 ChemAxon acceptor_count 20 ChemAxon donor_count 12 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 23982 Specdb::NmrOneD 23983 Specdb::NmrOneD 23984 Specdb::NmrOneD 23985 Specdb::NmrOneD 23986 Specdb::NmrOneD 23987 Specdb::NmrOneD 23988 Specdb::NmrOneD 23989 Specdb::NmrOneD 23990 Specdb::NmrOneD 23991 Specdb::NmrOneD 23992 Specdb::NmrOneD 23993 Specdb::NmrOneD 23994 Specdb::NmrOneD 23995 Specdb::NmrOneD 23996 Specdb::NmrOneD 23997 Specdb::NmrOneD 23998 Specdb::NmrOneD 23999 Specdb::NmrOneD 24000 Specdb::NmrOneD 24001 Specdb::MsMs 57198 Specdb::MsMs 57199 Specdb::MsMs 57200 Specdb::MsMs 112800 Specdb::MsMs 112801 Specdb::MsMs 112802 Specdb::MsMs 2810924 Specdb::MsMs 2810925 Specdb::MsMs 2810926 Specdb::MsMs 2895394 Specdb::MsMs 2895395 Specdb::MsMs 2895396 Specdb::CMs 780799 Specdb::CMs 780800 Specdb::CMs 780801 Specdb::CMs 780802 Specdb::CMs 780803 Specdb::CMs 780804 Specdb::CMs 780805 Specdb::CMs 780806 Specdb::CMs 780807 Specdb::CMs 780808 Specdb::CMs 780809 Specdb::CMs 780810 Specdb::CMs 780811 Specdb::CMs 780812 Specdb::CMs 780813 Specdb::CMs 780814 Specdb::CMs 780815 Specdb::CMs 780816 Specdb::CMs 780817 Specdb::CMs 780818 Specdb::CMs 780819 Specdb::CMs 780820 Specdb::CMs 780821 Specdb::CMs 780822 HMDB37959 #<Reference:0x000055ce32120808> Alcoholic beverages Unknown generic Ginkgo nuts Type 1 specific Ginkgo biloba 3311 Pulses Unknown generic Redcurrant Type 1 specific Ribes rubrum 175228 Soy bean Type 1 specific Glycine max 3847