1.0 2010-04-08 22:12:30 UTC 2019-11-26 03:13:26 UTC FDB016547 Eriodictyol 7-rutinoside Isolated from Mentha piperita (peppermint) leaves and from Citrus subspecies Eriocitrin is a flavonoid glycoside that can be found in plants like Citrus grandis, Citrus limon, Mentha longifolia, Mentha piperita, Thymus vulgaris. It shows important antioxidant activities. Eriocitrin Eriodictioside Eriodictyol 7-O-rutinoside Eriodictyol 7-rutinoside C27H32O15 596.534 596.174120354 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-one 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-2,3-dihydro-1-benzopyran-4-one 13463-28-0 CC1OC(OCC2OC(OC3=CC4=C(C(=O)CC(O4)C4=CC=C(O)C(O)=C4)C(O)=C3)C(O)C(O)C2O)C(O)C(O)C1O InChI=1S/C27H32O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)10-2-3-12(28)13(29)4-10/h2-6,9,16,18,20-30,32-37H,7-8H2,1H3 OMQADRGFMLGFJF-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 Alkyl aryl ethers Aryl alkyl ketones Benzene and substituted derivatives Catechols Chromones Disaccharides Flavanones Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Polyols Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3'-hydroxyflavonoid 4'-hydroxyflavonoid 5-hydroxyflavonoid Acetal Alcohol Alkyl aryl ether Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Catechol Chromane Chromone Disaccharide Ether Flavan Flavanone Flavonoid-7-o-glycoside Glycosyl compound Hydrocarbon derivative Hydroxyflavonoid Ketone Monocyclic benzene moiety O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Phenolic glycoside Polyol Secondary alcohol Vinylogous acid Solid logp -0.35 ALOGPS logs -2.23 ALOGPS solubility 3.53e+00 g/l ALOGPS melting_point Mp 167-172° logp -0.46 ChemAxon pka_strongest_acidic 8.54 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 596.534 ChemAxon mono_mass 596.174120354 ChemAxon smiles CC1OC(OCC2OC(OC3=CC4=C(C(=O)CC(O4)C4=CC=C(O)C(O)=C4)C(O)=C3)C(O)C(O)C2O)C(O)C(O)C1O ChemAxon formula C27H32O15 ChemAxon inchi InChI=1S/C27H32O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)10-2-3-12(28)13(29)4-10/h2-6,9,16,18,20-30,32-37H,7-8H2,1H3 ChemAxon inchikey OMQADRGFMLGFJF-UHFFFAOYSA-N ChemAxon polar_surface_area 245.29 ChemAxon refractivity 136.28 ChemAxon polarizability 58.06 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 15 ChemAxon donor_count 9 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 69633 Specdb::MsMs 69634 Specdb::MsMs 69635 Specdb::MsMs 127953 Specdb::MsMs 127954 Specdb::MsMs 127955 HMDB05811 28709 Citrus Unknown generic Grapefruit Type 1 specific Citrus X paradisi 37656 0.157925 0.157924531 0.157924531 mg/100 g Herbs and Spices Unknown generic Lemon Type 1 specific Citrus limon 2708 11.737148 21.290476118 0.1 mg/100 g Lime Type 1 specific Citrus aurantiifolia 159033 5.445714 5.445714406 5.445714406 mg/100 g Orange mint Type 1 specific Mentha aquatica 190902 Peppermint Type 1 specific Mentha X piperita 34256 4068.789815 8051.579629686 86.0 mg/100 g Pomegranate Type 1 specific Punica granatum 22663 Spearmint Type 1 specific Mentha spicata 29719 Sweet orange Type 1 specific Citrus sinensis 2711 0.18125 0.362499996 0.0 mg/100 g Winter savory Type 1 specific Satureja montana 49988