1.02010-04-08 22:14:48 UTC2019-11-26 03:18:28 UTCFDB020103Hesperetin 7-(2,6-dirhamnosylglucoside)Constituent of Citrus subspecies Hesperetin 7-(2,6-dirhamnosylglucoside) is found in citrus.5,7,3'-Trihydroxy-4'-methoxyflavanone 7-(2,6-dirhamnosylglucoside)Hesperetin 7-(2,6-dirhamnosylglucoside)Hesperetin 7-O-[a-L-rhamnopyranosyl-(1->2)-[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside]C34H44O19756.7018756.2476792267-({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)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one7-({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)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydro-1-benzopyran-4-one97218-30-9COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O1InChI=1S/C34H44O19/c1-11-23(38)26(41)29(44)32(48-11)47-10-21-25(40)28(43)31(53-33-30(45)27(42)24(39)12(2)49-33)34(52-21)50-14-7-16(36)22-17(37)9-19(51-20(22)8-14)13-4-5-18(46-3)15(35)6-13/h4-8,11-12,19,21,23-36,38-45H,9-10H2,1-3H3LMWHBZYEUQWDBE-UHFFFAOYSA-N belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position.Flavonoid-7-O-glycosidesOrganic compoundsPhenylpropanoids and polyketidesFlavonoidsFlavonoid glycosidesAromatic heteropolycyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids3'-hydroxyflavonoids4'-O-methylated flavonoids5-hydroxyflavonoidsAcetalsAlkyl aryl ethersAnisolesAryl alkyl ketonesChromonesFlavanonesHydrocarbon derivativesMethoxybenzenesMethoxyphenolsO-glycosyl compoundsOligosaccharidesOrganic oxidesOxacyclic compoundsOxanesPhenolic glycosidesPhenoxy compoundsPolyolsSecondary alcoholsVinylogous acids1-benzopyran1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoid3'-hydroxyflavonoid4p-methoxyflavonoid-skeleton5-hydroxyflavonoidAcetalAlcoholAlkyl aryl etherAnisoleAromatic heteropolycyclic compoundAryl alkyl ketoneAryl ketoneBenzenoidBenzopyranChromaneChromoneEtherFlavanFlavanoneFlavonoid-7-o-glycosideGlycosyl compoundHydrocarbon derivativeHydroxyflavonoidKetoneMethoxybenzeneMethoxyphenolMonocyclic benzene moietyO-glycosyl compoundOligosaccharideOrganic oxideOrganic oxygen compoundOrganoheterocyclic compoundOrganooxygen compoundOxacycleOxanePhenolPhenol etherPhenolic glycosidePhenoxy compoundPolyolSecondary alcoholVinylogous acidlogp-0.39logs-2.13solubility5.55e+00 g/llogp-1pka_strongest_acidic9.51pka_strongest_basic-3.6iupac7-({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)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-oneaverage_mass756.7018mono_mass756.247679226smilesCOC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O1formulaC34H44O19inchiInChI=1S/C34H44O19/c1-11-23(38)26(41)29(44)32(48-11)47-10-21-25(40)28(43)31(53-33-30(45)27(42)24(39)12(2)49-33)34(52-21)50-14-7-16(36)22-17(37)9-19(51-20(22)8-14)13-4-5-18(46-3)15(35)6-13/h4-8,11-12,19,21,23-36,38-45H,9-10H2,1-3H3inchikeyLMWHBZYEUQWDBE-UHFFFAOYSA-Npolar_surface_area293.21refractivity171.64polarizability75.39rotatable_bond_count9acceptor_count19donor_count10physiological_charge0formal_charge0Specdb::CMs781235Specdb::CMs781236Specdb::CMs781237Specdb::CMs781238Specdb::CMs781239Specdb::CMs781240Specdb::CMs781241Specdb::CMs781242Specdb::CMs781243Specdb::CMs781244Specdb::CMs781245Specdb::CMs781246Specdb::CMs781247Specdb::CMs781248Specdb::CMs781249Specdb::CMs781250Specdb::CMs781251Specdb::CMs781252Specdb::CMs781253Specdb::CMs781254Specdb::MsMs304237Specdb::MsMs304238Specdb::MsMs304239Specdb::MsMs347377Specdb::MsMs347378Specdb::MsMs347379Specdb::MsMs2709524Specdb::MsMs2709525Specdb::MsMs2709526Specdb::MsMs2995808Specdb::MsMs2995809Specdb::MsMs2995810Specdb::NmrOneD40082Specdb::NmrOneD40083Specdb::NmrOneD40084Specdb::NmrOneD40085Specdb::NmrOneD40086Specdb::NmrOneD40087Specdb::NmrOneD40088Specdb::NmrOneD40089Specdb::NmrOneD40090Specdb::NmrOneD40091Specdb::NmrOneD40092Specdb::NmrOneD40093Specdb::NmrOneD40094Specdb::NmrOneD40095Specdb::NmrOneD40096Specdb::NmrOneD40097Specdb::NmrOneD40098Specdb::NmrOneD40099Specdb::NmrOneD40100Specdb::NmrOneD40101HMDB40372#<Reference:0x000055567448b3e8>CitrusUnknowngeneric