1.0 2010-04-08 22:13:09 UTC 2025-11-19 01:54:59 UTC FDB017546 Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->2)-[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside] Constituent of peanut skins (Arachis hypogaea). Isorhamnetin 3-O-[b-D-xylopyranosyl-(1->2)-[a-L-rhamnopyranosyl-(1->6)]-b-D-glucopyranoside] is found in nuts. C33H40O20 756.6587 756.21129372 3-[(4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one 3-[(4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one COC1=C(O)C=CC(=C1)C1=C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(=O)C2=C(O)C=C(O)C=C2O1 InChI=1S/C33H40O20/c1-10-20(38)24(42)27(45)31(49-10)48-9-18-22(40)25(43)30(53-32-26(44)21(39)15(37)8-47-32)33(51-18)52-29-23(41)19-14(36)6-12(34)7-17(19)50-28(29)11-3-4-13(35)16(5-11)46-2/h3-7,10,15,18,20-22,24-27,30-40,42-45H,8-9H2,1-2H3 LYHLDPZVLVMMLI-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'-O-methylated flavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Acetals Alkyl aryl ethers Anisoles Chromones Flavones Heteroaromatic compounds Hydrocarbon derivatives Methoxybenzenes Methoxyphenols O-glycosyl compounds Oligosaccharides Organic oxides Oxacyclic compounds Oxanes Phenoxy compounds Polyols Pyranones and derivatives Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3p-methoxyflavonoid-skeleton 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Ether Flavone Flavonoid-3-o-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Methoxybenzene Methoxyphenol Monocyclic benzene moiety O-glycosyl compound Oligosaccharide Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenol ether Phenoxy compound Polyol Pyran Pyranone Secondary alcohol Vinylogous acid logp -0.36 ALOGPS logs -2.02 ALOGPS solubility 7.15e+00 g/l ALOGPS logp -1.9 ChemAxon pka_strongest_acidic 6.44 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3-[(4,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-2-yl)oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one ChemAxon average_mass 756.6587 ChemAxon mono_mass 756.21129372 ChemAxon smiles COC1=C(O)C=CC(=C1)C1=C(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2OC2OCC(O)C(O)C2O)C(=O)C2=C(O)C=C(O)C=C2O1 ChemAxon formula C33H40O20 ChemAxon inchi InChI=1S/C33H40O20/c1-10-20(38)24(42)27(45)31(49-10)48-9-18-22(40)25(43)30(53-32-26(44)21(39)15(37)8-47-32)33(51-18)52-29-23(41)19-14(36)6-12(34)7-17(19)50-28(29)11-3-4-13(35)16(5-11)46-2/h3-7,10,15,18,20-22,24-27,30-40,42-45H,8-9H2,1-2H3 ChemAxon inchikey LYHLDPZVLVMMLI-UHFFFAOYSA-N ChemAxon polar_surface_area 313.44 ChemAxon refractivity 171.08 ChemAxon polarizability 71.82 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 20 ChemAxon donor_count 11 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 780823 Specdb::CMs 780824 Specdb::CMs 780825 Specdb::CMs 780826 Specdb::CMs 780827 Specdb::CMs 780828 Specdb::CMs 780829 Specdb::CMs 780830 Specdb::CMs 780831 Specdb::CMs 780832 Specdb::CMs 780833 Specdb::CMs 780834 Specdb::CMs 780835 Specdb::CMs 780836 Specdb::CMs 780837 Specdb::CMs 780838 Specdb::CMs 780839 Specdb::CMs 780840 Specdb::CMs 780841 Specdb::CMs 780842 Specdb::CMs 780843 Specdb::CMs 780844 Specdb::MsMs 92289 Specdb::MsMs 92290 Specdb::MsMs 92291 Specdb::MsMs 155880 Specdb::MsMs 155881 Specdb::MsMs 155882 Specdb::MsMs 2314514 Specdb::MsMs 2314515 Specdb::MsMs 2314516 Specdb::MsMs 2621186 Specdb::MsMs 2621187 Specdb::MsMs 2621188 Specdb::NmrOneD 25302 Specdb::NmrOneD 25303 Specdb::NmrOneD 25304 Specdb::NmrOneD 25305 Specdb::NmrOneD 25306 Specdb::NmrOneD 25307 Specdb::NmrOneD 25308 Specdb::NmrOneD 25309 Specdb::NmrOneD 25310 Specdb::NmrOneD 25311 Specdb::NmrOneD 25312 Specdb::NmrOneD 25313 Specdb::NmrOneD 25314 Specdb::NmrOneD 25315 Specdb::NmrOneD 25316 Specdb::NmrOneD 25317 Specdb::NmrOneD 25318 Specdb::NmrOneD 25319 Specdb::NmrOneD 25320 Specdb::NmrOneD 25321 HMDB38253 #<Reference:0x000055ce328af880> Nuts Unknown generic