1.0 2010-04-08 22:12:29 UTC 2025-11-19 01:47:35 UTC FDB016511 Diosmetin 7-glucuronide Isolated from Majorana hortensis (sweet majoram). Diosmetin 7-glucuronide is found in spearmint, sweet marjoram, and fats and oils. 7-O-b-D-Glucuronopyranoside Diosmetin 7-glucuronide Diosmetin 7-O-beta-D-glucuronopyranoside Luteolin 4'-methyl ether 7-glucuronide C22H20O12 476.387 476.095476104 3,4,5-trihydroxy-6-{[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid 3,4,5-trihydroxy-6-{[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxane-2-carboxylic acid 35110-20-4 COC1=C(O)C=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(C(O)C(O)C3O)C(O)=O)C=C2O1 InChI=1S/C22H20O12/c1-31-13-3-2-8(4-10(13)23)14-7-12(25)16-11(24)5-9(6-15(16)33-14)32-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-7,17-20,22-24,26-28H,1H3,(H,29,30) XCKMDTYMOHXUHG-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-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 Acetals Benzene and substituted derivatives C-glycosyl compounds Catechols Chromones Dialkyl ethers Flavones Flavonoid 8-C-glycosides Heteroaromatic compounds Hydrocarbon derivatives Monosaccharides O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols 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 Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran C-glycosyl compound Catechol Chromone Dialkyl ether Ether Flavone Flavonoid c-glycoside Flavonoid-7-o-glycoside Flavonoid-8-c-glycoside Glycosyl compound Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenolic glycoside Polyol Primary alcohol Pyran Pyranone Secondary alcohol Vinylogous acid logp 1.09 ALOGPS logs -2.66 ALOGPS solubility 1.05e+00 g/l ALOGPS logp 0.6 ChemAxon pka_strongest_acidic 2.74 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 3,4,5-trihydroxy-6-{[5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}oxane-2-carboxylic acid ChemAxon average_mass 476.387 ChemAxon mono_mass 476.095476104 ChemAxon smiles COC1=C(O)C=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(C(O)C(O)C3O)C(O)=O)C=C2O1 ChemAxon formula C22H20O12 ChemAxon inchi InChI=1S/C22H20O12/c1-31-13-3-2-8(4-10(13)23)14-7-12(25)16-11(24)5-9(6-15(16)33-14)32-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-7,17-20,22-24,26-28H,1H3,(H,29,30) ChemAxon inchikey XCKMDTYMOHXUHG-UHFFFAOYSA-N ChemAxon polar_surface_area 192.44 ChemAxon refractivity 111.39 ChemAxon polarizability 45.37 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 12 ChemAxon donor_count 6 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 24803 Specdb::CMs 45397 Specdb::CMs 161766 Specdb::MsMs 7265 Specdb::MsMs 7266 Specdb::MsMs 7267 Specdb::MsMs 13937 Specdb::MsMs 13938 Specdb::MsMs 13939 Specdb::MsMs 2252195 Specdb::MsMs 2272938 Specdb::MsMs 2272939 Specdb::MsMs 2272940 Specdb::MsMs 3068617 Specdb::MsMs 3068618 Specdb::MsMs 3068619 HMDB37452 #<Reference:0x000055ce33512cf8> Fats and oils Unknown generic Spearmint Type 1 specific Mentha spicata 29719 Sweet marjoram Type 1 specific Origanum majorana 268884