1.0 2016-05-25 18:13:03 UTC 2026-05-14 19:59:22 UTC Isorhamnetin SmallMolecule Isorhamnetin is an organic compound with the formula C16H12O7 and an average molecular weight of 316.26 g/mol. Isorhamnetin belongs to the flavones, a subclass of flavonoids within the organic compounds. In biological contexts, it functions as an antioxidant (PMC4665427) and an anticoagulant (PMC9687696), and it has a therapeutic effect on inflammation (PMC9785621). It is recorded as an inhibitor of the protein target Cytochrome P450 1B1 (CYP1B1). Industrially, the compound is used as a humectant. Isorhamnetin is found in or released from 18 recorded sources across various sectors. These include Electrical & Electronic Equipment, such as capacitors, batteries, printed circuit boards, cell phones, and wires and cables. In the food, food processing & cookware sector, it is associated with food contact materials, food packaging, the treatment of hops, and the preparation of vinegar, wine, or sparkling wine. It is also found in lubricants within the energy, oil & gas and industrial manufacturing & chemical processing sectors. Other sources include medical devices in the healthcare, pharmaceuticals & veterinary products sector, as well as synthetic textiles and carpets and rugs in the textiles, leather & furnishings sector. Recorded routes of exposure for this compound include touch, oral, and inhalation. PFAS Phytotoxin C16H12O7 316.2623 316.058302738 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one isorhamnetin 480-19-3 COC1=C(O)C=CC(=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1 InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3 IZQSVPBOUDKVDZ-UHFFFAOYSA-N Organic compounds Phenylpropanoids and polyketides Flavonoids Flavones Flavonols 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 3'-O-methylated flavonoids 3-hydroxyflavonoids 4'-hydroxyflavonoids 5-hydroxyflavonoids 7-hydroxyflavonoids Alkyl aryl ethers Anisoles Chromones Heteroaromatic compounds Hydrocarbon derivatives Methoxybenzenes Methoxyphenols Organic oxides Oxacyclic compounds Phenoxy compounds Polyols Pyranones and derivatives Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 3-hydroxyflavone 3-hydroxyflavonoid 3p-methoxyflavonoid-skeleton 4'-hydroxyflavonoid 5-hydroxyflavonoid 7-hydroxyflavonoid Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Benzopyran Chromone Ether Heteroaromatic compound Hydrocarbon derivative Hydroxyflavonoid Methoxybenzene Methoxyphenol Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Phenol ether Phenoxy compound Polyol Pyran Pyranone Vinylogous acid Aromatic heteropolycyclic compounds 7-hydroxyflavonol Flavones and Flavonols Flavones and Flavonols flavonols monomethoxyflavone tetrahydroxyflavone Detected and Not Quantified logp 2.3 logp 1.96 ALOGPS logs -3.33 ALOGPS solubility 1.49e-01 g/l ALOGPS logp 2.3 ChemAxon pka_strongest_acidic 6.38 ChemAxon pka_strongest_basic -4 ChemAxon iupac 3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-chromen-4-one ChemAxon average_mass 316.2623 ChemAxon mono_mass 316.058302738 ChemAxon smiles COC1=C(O)C=CC(=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1 ChemAxon formula C16H12O7 ChemAxon inchi InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3 ChemAxon inchikey IZQSVPBOUDKVDZ-UHFFFAOYSA-N ChemAxon polar_surface_area 116.45 ChemAxon refractivity 81.34 ChemAxon polarizability 30.58 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 7 ChemAxon donor_count 4 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f722227ef70> DB16767 5281654 4444973 BE0001111