1.0 2016-05-26 00:04:41 UTC 2026-03-27 00:37:30 UTC Quercitrin SmallMolecule Quercitrin is an organic compound with the chemical formula C21H20O11 and an average molecular weight of 448.38 g/mol. Quercitrin belongs to the flavonoid glycosides, a subclass of flavonoids within the organic compounds. Within the broader classification of chemical substances, it is categorized under the superclass of phenylpropanoids and polyketides. Biologically, this compound serves as an antioxidant (PMC10812391, PMC6244844). Regarding its health effects, it is associated with inflammation (PMC10812391). Quercitrin has been recorded in 20 different sources across various sectors. In the food, food processing, and cookware sector, it is found in food packaging, the treatment of hops, and the preparation of vinegar, wort, wine, or sparkling wine. It is present in textiles, leather, and furnishings, specifically in carpets, rugs, and synthetic textiles. Within the electrical and electronic equipment sector, it is associated with batteries, capacitors, printed circuit boards, cell phones, wires, and cables, among two other sources. Other recorded sources include lubricants in the energy, oil, and gas sector, medical devices in the healthcare, pharmaceuticals, and veterinary products sector, and indoor air in the air, dust, and atmospheric transport sector, along with three additional sectors. Recorded routes of exposure for the compound include oral, inhalation, and touch. PFAS Phytotoxin C21H20O11 448.3769 448.100561482 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one quercitrin 522-12-3 C[C@@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C=C2)[C@H](O)[C@H](O)[C@H]1O InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7-,15-,17+,18+,21-/m0/s1 OXGUCUVFOIWWQJ-HQBVPOQASA-N Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Flavonoid-3-O-glycosides 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Acetals Benzene and substituted derivatives Catechols Chromones Flavones Heteroaromatic compounds Hexoses Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols 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 7-hydroxyflavonoid Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzopyran Catechol Chromone Flavone Flavonoid-3-o-glycoside Glycosyl compound Heteroaromatic compound Hexose monosaccharide Hydrocarbon derivative Hydroxyflavonoid Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Polyol Pyran Pyranone Secondary alcohol Vinylogous acid Aromatic heteropolycyclic compounds Flavones and Flavonols alpha-L-rhamnoside flavonols monosaccharide derivative quercetin O-glycoside tetrahydroxyflavone Detected and Not Quantified logp 1.31 ALOGPS logs -2.40 ALOGPS solubility 1.79e+00 g/l ALOGPS logp 0.9 ChemAxon pka_strongest_acidic 6.37 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one ChemAxon average_mass 448.3769 ChemAxon mono_mass 448.100561482 ChemAxon smiles C[C@@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C=C2)[C@H](O)[C@H](O)[C@H]1O ChemAxon formula C21H20O11 ChemAxon inchi InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7-,15-,17+,18+,21-/m0/s1 ChemAxon inchikey OXGUCUVFOIWWQJ-HQBVPOQASA-N ChemAxon polar_surface_area 186.37 ChemAxon refractivity 107.73 ChemAxon polarizability 42.62 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 11 ChemAxon donor_count 7 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bd0145e70> 5280459 4444112