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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 22:36:15 UTC
Update Date2021-09-14 15:44:45 UTC
HMDB IDHMDB0037362
Secondary Accession Numbers
  • HMDB37362
Metabolite Identification
Common NameIsoquercitrin
DescriptionIsoquercitrin, also known as isotrifoliin, 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. Thus, isoquercitrin is considered to be a flavonoid. Isoquercitrin is an odorless tasting compound. Isoquercitrin is found, on average, in the highest concentration within a few different foods, such as black chokeberries (Photinia melanocarpa), teas (Camellia sinensis), and green tea and in a lower concentration in grape wine, pears (Pyrus communis), and rubus (blackberry, raspberry). Isoquercitrin has also been detected, but not quantified in, several different foods, such as bilberries (Vaccinium myrtillus), globe artichokes (Cynara scolymus), black-eyed peas (Vigna unguiculata ssp. unguiculata), common wheats (Triticum aestivum), and tortilla. This could make isoquercitrin a potential biomarker for the consumption of these foods. Isoquercitrin is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. Based on a literature review a significant number of articles have been published on Isoquercitrin.
Structure
Data?1594327437
Synonyms
ValueSource
2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneChEBI
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneChEBI
IsoquercetinChEBI
IsotrifoliinChEBI
2-(3,4-Dihidroxyphenyl)-3-(b-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneGenerator
2-(3,4-Dihidroxyphenyl)-3-(β-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneGenerator
2-(3,4-Dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneGenerator
2-(3,4-Dihydroxyphenyl)-3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneGenerator
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-oneMeSH
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxyMeSH
Flavone, 3,3',4',5,7-pentahydroxy-, 3-beta-D-glucofuranosideMeSH
IsoquercitinMeSH
IsoquercitrosideMeSH
Quercetin 3-(beta-D-glucofuranoside)MeSH
Quercetin 3-O-beta-D-glucofuranosideMeSH
Quercetin-3-O-beta-glucosideMeSH
Quercetin-3-O-glucosideMeSH
Quercetin-3-glucosideMeSH
TrifoliinMeSH
Trifoliin aMeSH
2-(3,4-Dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one, 9ciHMDB
3,3',4',5,7-Pentahydroxyflavone 3-beta-glucosideHMDB
3-Glucopyranosyloxy-3',4',5,7-tetrahydroxyflavoneHMDB
3-GlucosylquercetinHMDB
Glucosyl 3-quercetinHMDB
HirsutrinHMDB
Quercetin 3-beta-D-glucosideHMDB
Quercetin 3-beta-glucosideHMDB
Quercetin 3-beta-O-glucosideHMDB
Quercetin 3-D-glucosideHMDB
Quercetin 3-glucopyranosideHMDB
Quercetin 3-glucosideHMDB
Quercetin 3-monoglucosideHMDB
Quercetin 3-O-glucopyranosideHMDB
Quercetin 3-O-glucosideHMDB
Quercetol 3-glucosideHMDB
Quercetol 3-monoglucosideHMDB
IsoquercitrinChEBI
Quercetin 3-O-b-D-glucopyranosideGenerator
Quercetin 3-O-β-D-glucopyranosideGenerator
3-O-beta-D-GlucopyranosylquercetinPhytoBank
3-O-β-D-GlucopyranosylquercetinPhytoBank
3-beta-D-GlucosylquercetinPhytoBank
3-β-D-GlucosylquercetinPhytoBank
3',4',5,7-Tetrahydroxyflavone-3-beta-D-glucopyranosidePhytoBank
3',4',5,7-Tetrahydroxyflavone-3-β-D-glucopyranosidePhytoBank
3’,4’,5,7-Tetrahydroxyflavone-3-β-D-glucopyranosidePhytoBank
Contigoside BPhytoBank
Glucosyl-3-quercetinPhytoBank
IsoquercetrinPhytoBank
Quercetin 3-O-beta-D-glucopyranosidePhytoBank
Quercetin 3-O-beta-D-glucosidePhytoBank
Quercetin 3-O-β-D-glucosidePhytoBank
Quercetin 3-O-beta-glucosidePhytoBank
Quercetin 3-O-β-glucosidePhytoBank
Quercetin 3-mono-D-glucosidePhytoBank
Quercetin 3-beta-D-glucopyranosidePhytoBank
Quercetin 3-β-D-glucopyranosidePhytoBank
Quercetin 3-β-D-glucosidePhytoBank
Quercetin 3beta-O-glucosidePhytoBank
Quercetin 3β-O-glucosidePhytoBank
Quercetin 3beta-glucosidePhytoBank
Quercetin 3β-glucosidePhytoBank
Quercetin glucosidePhytoBank
Quercetin-3-glucosePhytoBank
Quercetin-3-beta-glucopyranosidePhytoBank
Quercetin-3-β-glucopyranosidePhytoBank
Chemical FormulaC21H20O12
Average Molecular Weight464.3763
Monoisotopic Molecular Weight464.095476104
IUPAC Name2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
Traditional Nameisoquercitin
CAS Registry Number482-35-9
SMILES
OC[C@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O
InChI Identifier
InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1
InChI KeyOVSQVDMCBVZWGM-QSOFNFLRSA-N
Chemical Taxonomy
Description 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.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassFlavonoids
Sub ClassFlavonoid glycosides
Direct ParentFlavonoid-3-O-glycosides
Alternative Parents
Substituents
  • Flavonoid-3-o-glycoside
  • Hydroxyflavonoid
  • 3'-hydroxyflavonoid
  • 4'-hydroxyflavonoid
  • 5-hydroxyflavonoid
  • 7-hydroxyflavonoid
  • Flavone
  • Hexose monosaccharide
  • Chromone
  • Glycosyl compound
  • O-glycosyl compound
  • Benzopyran
  • 1-benzopyran
  • Catechol
  • 1-hydroxy-2-unsubstituted benzenoid
  • Phenol
  • Pyranone
  • 1-hydroxy-4-unsubstituted benzenoid
  • Monocyclic benzene moiety
  • Benzenoid
  • Pyran
  • Monosaccharide
  • Oxane
  • Vinylogous acid
  • Heteroaromatic compound
  • Secondary alcohol
  • Organoheterocyclic compound
  • Oxacycle
  • Polyol
  • Acetal
  • Hydrocarbon derivative
  • Organic oxide
  • Organic oxygen compound
  • Alcohol
  • Primary alcohol
  • Organooxygen compound
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External Descriptors
Ontology
Disposition

Route of exposure:

Source:

Biological location:

Role

Industrial application:

Biological role:

Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point238 - 242 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility1.95 g/LALOGPS
logP0.47ALOGPS
logP-0.14ChemAxon
logS-2.4ALOGPS
pKa (Strongest Acidic)6.37ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area206.6 ŲChemAxon
Rotatable Bond Count4ChemAxon
Refractivity109.28 m³·mol⁻¹ChemAxon
Polarizability43.56 ųChemAxon
Number of Rings4ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Spectral Properties

Collision Cross Sections

NameAdductTypeData SourceValueReference

Retention Indices

Underivatized

Not Available

Derivatized

DerivativeValueReference
Isoquercitrin,1TMS,#14293.243https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#24344.234https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#34398.432https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#44352.5366https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#54342.298https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#64343.512https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#74335.8022https://arxiv.org/abs/1905.12712
Isoquercitrin,1TMS,#84314.2515https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#14184.054https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#24171.5146https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#34220.025https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#44193.7188https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#54217.3027https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#64211.633https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#74222.3354https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#84244.2085https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#94229.5293https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#104216.346https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#114210.795https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#124224.6543https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#134223.8896https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#144226.3804https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#154240.829https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#164251.462https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#174232.148https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#184220.7383https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#194194.0854https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#204213.1616https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#214218.783https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#224210.736https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#234180.0317https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#244193.697https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#254200.334https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#264199.432https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#274216.3984https://arxiv.org/abs/1905.12712
Isoquercitrin,2TMS,#284193.097https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#14087.0342https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#24067.7527https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#34062.1885https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#44106.1353https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#54087.3184https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#64113.745https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#74061.6318https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#84054.0825https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#94096.7583https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#104078.3398https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#114103.3643https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#124107.842https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#134148.2983https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#144131.742https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#154152.4683https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#164129.002https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#174114.867https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#184134.2305https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#194149.1177https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#204183.7974https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#214153.2754https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#224118.1226https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#234118.4985https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#244128.8794https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#254118.814https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#264116.528https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#274069.4453https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#284074.663https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#294084.4482https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#304096.8545https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#314062.077https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#324066.198https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#334076.0442https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#344115.559https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#354116.443https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#364131.6963https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#374134.0156https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#384137.261https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#394071.317https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#404069.5012https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#414154.7188https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#424072.1355https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#434067.8728https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#444090.2112https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#454084.7717https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#464105.799https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#474083.4978https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#484091.2815https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#494099.5073https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#504107.8823https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#514110.264https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#524119.2817https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#534080.1467https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#544085.2776https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#554102.186https://arxiv.org/abs/1905.12712
Isoquercitrin,3TMS,#564130.457https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#14019.4224https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#23997.89https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#34057.523https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#44024.918https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#54064.661https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#64008.7385https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#74013.946https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#83978.9077https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#94023.9775https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#104000.2195https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#113966.2954https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#124008.677https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#134052.973https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#144084.748https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#154057.3704https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#164003.2168https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#174009.17https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#183974.2434https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#194018.78https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#203992.7522https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#213957.6887https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#224000.268https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#234044.1936https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#244072.7197https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#254046.1045https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#264064.7788https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#274025.9146https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#284068.3884https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#294113.4346https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#304142.462https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#314113.7227https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#324089.9185https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#334120.1https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#344090.9226https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#354153.393https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#364046.859https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#374049.8533https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#384025.4404https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#394024.4348https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#404058.2808https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#414028.3206https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#424029.2754https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#434022.9814https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#444021.783https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#454057.1377https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#463985.1648https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#473983.731https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#484009.2744https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#493996.1384https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#503992.8015https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#514013.0747https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#523978.8367https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#533975.749https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#543988.8452https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#554084.42https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#564116.858https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#574001.2122https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#583998.0134https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#594002.9534https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#603996.827https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#614031.9934https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#624012.978https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#634007.7534https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#644009.961https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#654033.0283https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#664052.6938https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#674045.8083https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#684049.4https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#694058.1902https://arxiv.org/abs/1905.12712
Isoquercitrin,4TMS,#704047.8208https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#13992.3384https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#24002.51https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#33974.9233https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#44013.914https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#53982.1768https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#63956.5566https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#73991.483https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#84028.4922https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#94038.5093https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#104029.7766https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#113979.2046https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#123968.269https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#133988.8455https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#143984.691https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#153995.3398https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#163989.9058https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#173965.9546https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#183975.057https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#193970.676https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#204045.2148https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#213976.5347https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#223963.9995https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#233983.8645https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#243977.7344https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#253984.074https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#263980.6995https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#273957.578https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#283960.7256https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#293960.4214https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#304035.425https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#314006.1245https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#324014.9724https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#334005.4185https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#344112.95https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#354089.611https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#364024.0125https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#374006.4443https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#384006.1914https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#394001.2246https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#403998.1191https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#414017.2615https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#423999.15https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#433998.2075https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#444009.1929https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#454009.625https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#463980.2344https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#473982.3184https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#483978.8274https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#493983.3467https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#503970.4033https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#514004.752https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#523995.691https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#534004.1782https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#543999.9275https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#554007.716https://arxiv.org/abs/1905.12712
Isoquercitrin,5TMS,#564039.6355https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#13984.3743https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#23971.952https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#33987.026https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#43997.9858https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#53998.7349https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#64002.0012https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#73983.4517https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#83982.8115https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#93985.5464https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#104043.255https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#113975.485https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#123978.4624https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#133985.4666https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#144012.3164https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#153998.3481https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#163979.8257https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#173982.7263https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#183990.8203https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#194006.8247https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#203988.418https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#214018.2075https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#224004.6028https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#234009.1133https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#244010.688https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#254000.7534https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#264003.9568https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#274000.5796https://arxiv.org/abs/1905.12712
Isoquercitrin,6TMS,#284018.3718https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#14572.4883https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#24598.7817https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#34619.8677https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#44611.997https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#54586.2812https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#64581.1895https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#74583.6323https://arxiv.org/abs/1905.12712
Isoquercitrin,1TBDMS,#84564.6123https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#14664.554https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#24639.4106https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#34682.185https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#44662.798https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#54679.39https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#64662.0884https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#74677.2295https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#84696.257https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#94693.5117https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#104665.3857https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#114679.938https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#124682.4575https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#134687.8423https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#144692.7954https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#154698.2686https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#164706.1694https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#174710.9106https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#184683.8745https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#194664.237https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#204672.468https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#214677.6714https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#224664.12https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#234642.5483https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#244649.5884https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#254654.6025https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#264678.709https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#274697.2686https://arxiv.org/abs/1905.12712
Isoquercitrin,2TBDMS,#284679.3887https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#14735.859https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#24772.9756https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#34754.5503https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#44744.6445https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#54718.3706https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#64740.028https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#74745.9595https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#84726.849https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#94720.747https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#104696.152https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#114715.5244https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#124751.6997https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#134785.278https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#144752.7285https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#154778.3965https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#164761.497https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#174728.935https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#184754.8164https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#194780.1406https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#204797.205https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#214782.362https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#224774.051https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#234771.95https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#244772.708https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#254869.251https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#264830.503https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#274774.466https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#284784.4746https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#294776.66https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#304783.087https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#314747.142https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#324755.607https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#334748.8193https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#344743.073https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#354741.662https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#364759.7524https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#374764.139https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#384767.4453https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#394786.9795https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#404760.4707https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#414785.6597https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#424796.716https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#434767.202https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#444792.541https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#454764.82https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#464800.1787https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#474729.985https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#484731.311https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#494750.042https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#504751.8657https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#514747.708https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#524755.3https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#534711.583https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#544709.6064https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#554731.2593https://arxiv.org/abs/1905.12712
Isoquercitrin,3TBDMS,#564764.666https://arxiv.org/abs/1905.12712
Spectra

GC-MS

Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positivesplash10-0uea-8903800000-499ac85a438f6221151e2017-09-01View Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (3 TMS) - 70eV, Positivesplash10-014r-3620009000-aa92fb234d45c04fb4a12017-10-06View Spectrum

LC-MS/MS

Spectrum TypeDescriptionSplash KeyDeposition DateView
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-qTof , Positivesplash10-0udi-0009000000-5b33a5f16f6e2b064a262017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-03di-0000900000-04fd0a90f823358ed6802017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-03di-0001900000-a884073b5df03fc34d442017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0udi-0009200000-abf468a3d736431e673c2017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0udi-0019000000-6c4a0f0151f89b993af72017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0uk9-0096000000-2a8faa231ffe4833d3e52017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0w29-0179700000-4feff1360b5c3797e9452017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-03di-0003900002-fb997b013c890e4beb252017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0udi-0059000000-f059e0c8ce382613a8af2017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-03di-0000900000-2ca67c601c5cd16acf0e2017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , negativesplash10-0udi-0079400000-53c1ad9f9a822003ead82017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - , negativesplash10-0w29-0029400000-e04499260d75d9c877842017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009200000-57d1b2e15f55ae8093852017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009000000-0ac33fff6c0d20867fa42017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009000000-6b8e2bdefa584c75e6c62017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009000000-dff25d3afe49ed2abe872017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009000000-29733c57848cecc33e702017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0009000000-06624a60d6ef7aa134bb2017-09-14View Spectrum
LC-MS/MSLC-MS/MS Spectrum - LC-ESI-QTOF , positivesplash10-0udi-0109000000-cfa8aaba41883dcf51e52017-09-14View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0uxr-0238900000-84d67141521459a118c02016-08-01View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0udi-0269100000-855726a927e888161d782016-08-01View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0f79-2962000000-bc39b0d9e5586054d85f2016-08-01View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0ik9-1306900000-12c0a6f0c9db05e8c9bd2016-08-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0udi-2439200000-fc56cb8d8bcb486e96a62016-08-03View Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0zfr-6963000000-3bde95e6420d1d4a73e42016-08-03View Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen Locations
  • Blood
Tissue LocationsNot Available
Pathways
Normal Concentrations
BiospecimenStatusValueAgeSexConditionReferenceDetails
BloodExpected but not QuantifiedNot QuantifiedNot AvailableNot AvailableConsuming polyphenols described by Phenol-Explorer entry 293 details
BloodExpected but not QuantifiedNot QuantifiedNot AvailableNot AvailableConsuming polyphenols described by Phenol-Explorer entry 293 details
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDDB12665
Phenol Explorer Compound ID293
FooDB IDFDB016389
KNApSAcK IDC00005373
Chemspider ID4444361
KEGG Compound IDC05623
BioCyc IDCPD1F-437
BiGG IDNot Available
Wikipedia LinkIsoquercetin
METLIN IDNot Available
PubChem Compound5280804
PDB IDNot Available
ChEBI ID68352
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Amado NG, Cerqueira DM, Menezes FS, da Silva JF, Neto VM, Abreu JG: Isoquercitrin isolated from Hyptis fasciculata reduces glioblastoma cell proliferation and changes beta-catenin cellular localization. Anticancer Drugs. 2009 Aug;20(7):543-52. doi: 10.1097/CAD.0b013e32832d1149. [PubMed:19491660 ]
  2. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .