1.0 2010-04-08 22:10:51 UTC 2025-11-19 00:29:50 UTC FDB013693 Kaempferol 3-[glucosyl-(1->3)-rhamnosyl-(1->2)-[rhamnosyl-(1->6)-galactoside]] Constituent of the leaves of Maytenus aquifolium (tea). Kaempferol 3-[glucosyl-(1->3)-rhamnosyl-(1->2)-[rhamnosyl-(1->6)-galactoside]] is found in tea. 3-[(O-6-Deoxy-alpha-L-mannopyranosyl-(1->6)-O-[O-beta-D-glucopyranosyl-(1->3)-6-deoxy-alpha-L-mannopyranosyl-(1->2)]-beta-D-galactopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one Kaempferol 3-(2''-[glucosyl-(1->3)-rhamnosyl]-6''-rhamnosylgalactoside) Kaempferol 3-(2''-O-[b-D-glucopyranosyl-(1->3)-a-L-rhamnopyranosyl]-6''-O-rhamnopyranosyl)galactoside Kaempferol 3-[glucosyl-(1->3)-rhamnosyl-(1->2)-[rhamnosyl-(1->6)-galactoside]] Kaempferol 3-glucosyl-(1->3)-rhamnosyl-(1->2)-[rhamnosyl-(1->6)-galactoside] Trifolin 2''-O-[b-D-glucopyranosyl-(1->3)-a-L-rhamnopyranosyl] 6''-O-rhamnopyranoside Trifolin 2''-O-[b-D-glucosyl-(1->3)-a-L-rhamnosyl] 6''-O-rhamnoside Trifolin 2''-O-[glucosyl-(1->3)-rhamnoside] 6''-rhamnoside C39H50O24 902.7999 902.269202528 3-({3-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one 3-({3-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one 214407-43-9 CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(OC3OC(C)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2O)C(O)C(O)C1O InChI=1S/C39H50O24/c1-11-21(44)26(49)29(52)36(56-11)55-10-19-24(47)28(51)35(63-38-31(54)33(22(45)12(2)57-38)61-37-30(53)27(50)23(46)18(9-40)59-37)39(60-19)62-34-25(48)20-16(43)7-15(42)8-17(20)58-32(34)13-3-5-14(41)6-4-13/h3-8,11-12,18-19,21-24,26-31,33,35-47,49-54H,9-10H2,1-2H3 WGIYIIVVCUJTAO-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 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Acetals Benzene and substituted derivatives Chromones Flavones Heteroaromatic compounds Hydrocarbon derivatives O-glycosyl compounds Oligosaccharides Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran 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 Primary alcohol Pyran Pyranone Secondary alcohol Vinylogous acid logp -0.39 ALOGPS logs -1.66 ALOGPS solubility 1.96e+01 g/l ALOGPS logp -3.1 ChemAxon pka_strongest_acidic 6.43 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3-({3-[(3,5-dihydroxy-6-methyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one ChemAxon average_mass 902.7999 ChemAxon mono_mass 902.269202528 ChemAxon smiles CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(OC3OC(C)C(O)C(OC4OC(CO)C(O)C(O)C4O)C3O)C(O)C2O)C(O)C(O)C1O ChemAxon formula C39H50O24 ChemAxon inchi InChI=1S/C39H50O24/c1-11-21(44)26(49)29(52)36(56-11)55-10-19-24(47)28(51)35(63-38-31(54)33(22(45)12(2)57-38)61-37-30(53)27(50)23(46)18(9-40)59-37)39(60-19)62-34-25(48)20-16(43)7-15(42)8-17(20)58-32(34)13-3-5-14(41)6-4-13/h3-8,11-12,18-19,21-24,26-31,33,35-47,49-54H,9-10H2,1-2H3 ChemAxon inchikey WGIYIIVVCUJTAO-UHFFFAOYSA-N ChemAxon polar_surface_area 383.36 ChemAxon refractivity 201.45 ChemAxon polarizability 86.89 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 24 ChemAxon donor_count 14 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 7310 Specdb::MsMs 7311 Specdb::MsMs 7312 Specdb::MsMs 9650 Specdb::MsMs 9651 Specdb::MsMs 9652 Specdb::MsMs 13982 Specdb::MsMs 13983 Specdb::MsMs 13984 Specdb::MsMs 16322 Specdb::MsMs 16323 Specdb::MsMs 16324 Specdb::MsMs 2746417 Specdb::MsMs 2746418 Specdb::MsMs 2746419 Specdb::MsMs 2932056 Specdb::MsMs 2932057 Specdb::MsMs 2932058 Specdb::NmrOneD 129958 Specdb::NmrOneD 129959 Specdb::NmrOneD 129960 Specdb::NmrOneD 129961 Specdb::NmrOneD 129962 Specdb::NmrOneD 129963 Specdb::NmrOneD 129964 Specdb::NmrOneD 129965 Specdb::NmrOneD 129966 Specdb::NmrOneD 129967 Specdb::NmrOneD 129968 Specdb::NmrOneD 129969 Specdb::NmrOneD 129970 Specdb::NmrOneD 129971 Specdb::NmrOneD 129972 Specdb::NmrOneD 129973 Specdb::NmrOneD 129974 Specdb::NmrOneD 129975 Specdb::NmrOneD 129976 Specdb::NmrOneD 129977 HMDB35069 #<Reference:0x000055ce3249a5b0> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442