CHEBI:187087 - 6-C-Methylquercetin 3,3'-dimethyl ether

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 6-C-Methylquercetin 3,3'-dimethyl ether
ChEBI ID CHEBI:187087
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H16O7
Net Charge 0
Average Mass 344.319
Monoisotopic Mass 344.08960
InChI InChI=1S/C18H16O7/c1-8-11(20)7-13-14(15(8)21)16(22)18(24-3)17(25-13)9-4-5-10(19)12(6-9)23-2/h4-7,19-21H,1-3H3
InChIKey YYXIVLBFQSWHBO-UHFFFAOYSA-N
SMILES O1C2=C(C(O)=C(C(O)=C2)C)C(=O)C(OC)=C1C3=CC(OC)=C(O)C=C3
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing 6-C-Methylquercetin 3,3'-dimethyl ether (CHEBI:187087) is a ether (CHEBI:25698)
6-C-Methylquercetin 3,3'-dimethyl ether (CHEBI:187087) is a flavonoids (CHEBI:72544)
IUPAC Name
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-methoxy-6-methylchromen-4-one
Manual Xrefs Databases
24845389 ChemSpider
LMPK12112747 LIPID MAPS
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