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CHEBI:197061 - Luteolin 7-methylglucuronide

ChEBI IDCHEBI:197061
ChEBI NameLuteolin 7-methylglucuronide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H20O12
Net Charge0
Average Mass476.390
Monoisotopic Mass476.09548
SMILESCOC(=O)C1O[C@@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)C(O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C22H20O12/c1-31-21(30)20-18(28)17(27)19(29)22(34-20)32-9-5-12(25)16-13(26)7-14(33-15(16)6-9)8-2-3-10(23)11(24)4-8/h2-7,17-20,22-25,27-29H,1H3/t17-,18-,19?,20?,22+/m0/s1
InChIKeyVQDVPEBDINWLHZ-PVJCQVCVSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
Luteolin 7-methylglucuronide (CHEBI:197061) is a flavonoids (CHEBI:72544)
Luteolin 7-methylglucuronide (CHEBI:197061) is a glucosiduronic acid (CHEBI:24302)
IUPAC Name 
methyl (3S,4S,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
Manual XrefsDatabases
LMPK12110646LIPID MAPS
24843676ChemSpider